![L-Ornithinamide, L-valyl-N5-(aminocarbonyl)-N-[4-(hydroxymethyl) phenyl]- (9CI, ACI) H335, H319, H315, H302](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![L-Ornithinamide, L-valyl-N5-(aminocarbonyl)-N-[4-(hydroxymethyl) phenyl]- (9CI, ACI) H335, H319, H315, H302 Isithombe Esifakiwe](https://cdn.globalso.com/nvchem/L-Ornithinamide.jpg)
L-Ornithinamide, L-valyl-N5-(aminocarbonyl)-N-[4-(hydroxymethyl) phenyl]- (9CI, ACI) H335, H319, H315, H302
| Izici Zomzimba Eziyinhloko | Inani | Isimo |
| Isisindo samangqamuzana | 379.45 | - |
| Iphoyinti lokubilisa (elibikezelwe) | 715.0±60.0 °C | Cindezela: 760 Torr |
| Ukuminyana (Kubikezelwe) | 1.243±0.06 g/cm3 | Izinga lokushisa: 20 °C;Cindezela: 760 Torr |
| pKa (Kubikezelwe) | 13.75±0.46 | Izinga Le-Acidic Elikhulu: 25 °C |
I-Canonical AMAMOTHEKA O=C(N)NCCCC(NC(=O)C(N)C(C)C)C(=O)NC1=CC=C(C=C1)CO
I-Isomeric IMILESI [C@@H](NC([C@H](C(C)C)N)=O)(C(NC1=CC=C(CO)C=C1)=O)CCCNC(N) =O
I-InChI
I-InChI=1S/C18H29N5O4/c1-11(2)15(19)17(26)23-14(4-3-9-21-18(20)27)16(25)22-13-7-5- 12(10-24)6-8-13/h5-8,11,14-15,24H,3-4,9-10,19 H2,1-2H3,(H,22,25)(H,23) ,26)(H3,20,21,27)/t14-,15-/m0/s1
Ukhiye we-InchI
VEGGTWZUZGZKHY-GJZGRUSLSA-N
4 Amanye Amagama Alesi Sitho
L-Valyl-N5-(aminocarbonyl)-N[4-(hydroxymethyl)phenyl]-L-ornithinamide (ACI);1: PN: WO2023061224 IKHASI: 34 ukulandelana okufunwayo;I-Valine-Citrulline-p- i-aminobenzylcarbamate;Vc-PAB
| Izakhiwo ezitholakalayo |
| I-Biological |
| Amakhemikhali |
| Ukuminyana |
| I-Lipinski |
| Okuhlobene Nesakhiwo |
| Okushisayo |
I-Biological
| Impahla | Inani | Isimo | Umthombo |
| I-Bioconcentration Factor | 1.0 | i-pH 1;Izinga lokushisa: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1.0 | pH 2;Izinga lokushisa: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1.0 | i-pH 3;Izinga lokushisa: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1.0 | i-pH 4;Izinga lokushisa: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1.0 | pH 5;Izinga lokushisa: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1.0 | pH 6;Izinga lokushisa: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1.0 | pH 7;Izinga lokushisa: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1.0 | pH 8;Izinga lokushisa: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1.0 | pH 9;Izinga lokushisa: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1.0 | pH 10;Izinga lokushisa: 25 °C | (1) ACD |
(1) Kubalwe kusetshenziswa i-Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Amakhemikhali
| Impahla | Inani | Isimo | Umthombo |
| Koc | 1.0 | i-pH 1;Izinga lokushisa: 25 °C | (1) ACD |
| Koc | 1.0 | pH 2;Izinga lokushisa: 25 °C | (1) ACD |
| Koc | 1.0 | i-pH 3;Izinga lokushisa: 25 °C | (1) ACD |
| Koc | 1.0 | i-pH 4;Izinga lokushisa: 25 °C | (1) ACD |
| Koc | 1.0 | pH 5;Izinga lokushisa: 25 °C | (1) ACD |
| Koc | 1.0 | pH 6;Izinga lokushisa: 25 °C | (1) ACD |
| Koc | 1.0 | pH 7;Izinga lokushisa: 25 °C | (1) ACD |
| Koc | 6.00 | pH 8;Izinga lokushisa: 25 °C | (1) ACD |
| Koc | 13.2 | pH 9;Izinga lokushisa: 25 °C | (1) ACD |
| Koc | 15.0 | pH 10;Izinga lokushisa: 25 °C | (1) ACD |
| Impahla | Inani | Isimo | Umthombo |
| logD | -3.53 | i-pH 1;Izinga lokushisa: 25 °C | (1) ACD |
| logD | -3.46 | pH 2;Izinga lokushisa: 25 °C | (1) ACD |
| logD | -3.45 | i-pH 3;Izinga lokushisa: 25 °C | (1) ACD |
| logD | -3.42 | i-pH 4;Izinga lokushisa: 25 °C | (1) ACD |
| logD | -3.20 | pH 5;Izinga lokushisa: 25 °C | (1) ACD |
| logD | -2.50 | pH 6;Izinga lokushisa: 25 °C | (1) ACD |
| logD | -1.57 | pH 7;Izinga lokushisa: 25 °C | (1) ACD |
| logD | -0.76 | pH 8;Izinga lokushisa: 25 °C | (1) ACD |
| logD | -0.42 | pH 9;Izinga lokushisa: 25 °C | (1) ACD |
| logD | -0.36 | pH 10;Izinga lokushisa: 25 °C | (1) ACD |
| logP | -0.354±0.602 | Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Intrinsic Solubility | 1.6 g/L | Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 1000 g/L | i-pH 1;Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 1000 g/L | pH 2;Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 1000 g/L | i-pH 3;Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 1000 g/L | i-pH 4;Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 1000 g/L | pH 5;Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 220 g/L | pH 6;Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 26 g/L | pH 7;Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 4.2 g/L | pH 8;Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 1.9 g/L | pH 9;Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 1.6 g/L | pH 10;Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 1.6 g/L | Amanzi Angakhiqiziwe pH 9.89;Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Intrinsic Solubility | 4.2 x 10-3 mol/L | Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Solubility | 2.64 mol/L | i-pH 1;Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Solubility | 2.64 mol/L | pH 2;Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Solubility | 2.64 mol/L | i-pH 3;Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Solubility | 2.64 mol/L | i-pH 4;Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Solubility | 2.64 mol/L | pH 5;Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Solubility | 0.59 mol/L | pH 6;Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Solubility | 0.069 mol/L | pH 7;Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Solubility | 0.011 mol/L | pH 8;Izinga lokushisa: 25 °C | (1) ACD |
| Impahla | Inani | Isimo | Umthombo |
| I-Molar Solubility | 4.9 x 10-3 mol/L | pH 9;Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Solubility | 4.3 x 10-3 mol/L | pH 10;Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Solubility | 4.3 x 10-3 mol/L | Amanzi Angakhiqiziwe pH 9.89;Izinga lokushisa: 25 °C | (1) ACD |
| Isisindo samangqamuzana | 379.45 | ||
| pKa | 13.75±0.46 | Izinga Le-Acidic Elikhulu: 25 °C | (1) ACD |
| pKa | 8.19±0.33 | Izinga Lokushisa Eziyisisekelo: 25 °C | (1) ACD |
| I-Vapor Pressure | 1.86 x 10-21 Torr | Izinga lokushisa: 25 °C | (1) ACD |
(1) Kubalwe kusetshenziswa i-Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Ukuminyana
| Impahla | Inani | Isimo | Umthombo |
| Ukuminyana | 1.243±0.06 g/cm3 | Izinga lokushisa: 20 °C;Cindezela: 760 Torr | (1) ACD |
| Ivolumu ye-Molar | 305.2±3.0 cm3/mol | Izinga lokushisa: 20 °C;Cindezela: 760 Torr | (1) ACD |
(1) Kubalwe kusetshenziswa i-Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
I-Lipinski
| Impahla | Inani | Isimo | Umthombo |
| Amabhondi Ashintshashintshayo Ngokukhululekile | 12 | (1) ACD | |
| H Abamukelayo | 9 | (1) ACD | |
| H Abaxhasi | 8 | (1) ACD | |
| H Isamba Somnikeli/Umamukeli | 17 | (1) ACD | |
| logP | -0.354±0.602 | Izinga lokushisa: 25 °C | (1) ACD |
| Isisindo samangqamuzana | 379.45 |
(1) Kubalwe kusetshenziswa i-Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Okuhlobene Nesakhiwo
| Impahla | Inani | Isimo | Umthombo |
| Indawo ye-Polar Surface | 160 A2 | (1) ACD | |
(1) Kubalwe kusetshenziswa i-Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Okushisayo
| Impahla | Inani | Isimo | Umthombo |
| Iphuzu elibilayo | 715.0±60.0 °C | Cindezela: 760 Torr | (1) ACD |
| I-Enthalpy ye-Vaporization | 109.72±3.0 kJ/mol | Cindezela: 760 Torr | (1) ACD |
| I-Flash Point | 386.2±32.9 °C | (1) ACD |
(1) Kubalwe kusetshenziswa i-Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
I-Spectra iyatholakala
1H NMR
13C NMR
| Ikhodi | Isitatimende Sengozi | Umthombo |
| H335 | Ingabangela ukucasuka kokuphefumula | I-European Chemical Agency (ECHA) Classification&Labelling Inventory - Izigaba ezaziswe nokulebula - izaziso ezivame kakhulu, I-European Chemical Agency (ECHA) Classification&Labelling Inventory - Isigaba esazisiwe kanye nokulebula - izaziso ezibucayi kakhulu |
| H319 | Ibangela ukucasuka kwamehlo okukhulu | I-European Chemical Agency (ECHA) Classification&Labelling Inventory - Izigaba ezaziswe nokulebula - izaziso ezivame kakhulu, I-European Chemical Agency (ECHA) Classification&Labelling Inventory - Isigaba esazisiwe kanye nokulebula - izaziso ezibucayi kakhulu |
| H315 | Ibangela ukucasuka kwesikhumba | I-European Chemical Agency (ECHA) Classification&Labelling Inventory - Izigaba ezaziswe nokulebula - izaziso ezivame kakhulu, I-European Chemical Agency (ECHA) Classification&Labelling Inventory - Isigaba esazisiwe kanye nokulebula - izaziso ezibucayi kakhulu |
| H302 | Iyingozi uma igwinywe | I-European Chemical Agency (ECHA) Classification&Labelling Inventory - Izigaba ezaziswe nokulebula - izaziso ezivame kakhulu, I-European Chemical Agency (ECHA) Classification&Labelling Inventory - Isigaba esazisiwe kanye nokulebula - izaziso ezibucayi kakhulu |
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