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| Ligand Name: N-[(benzyloxy)carbonyl]glycyl-N-[(2S,3R)-4-chloro-3-oxo-1-phenylbutan-2-yl]glycinamide |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB1483 |
PubChem:
10388837
|
Synonym(s):
- z-gly-gly-phe-chloromethylketone
- 35172-59-9
- benzyl n-[2-[[2-[[(2s)-4-chloro-3-oxo-1-phenylbutan-2-yl]amino]-2-oxoethyl]amino]-2-oxoethyl]carbamate
- z-gly-gly-phe chloromethylketone
- dtxsid30439127
- zinc5179489
- mfcd00057806
- n-[(benzyloxy)carbonyl]glycyl-n-[(2s)-4-chloro-3-oxo-1-phenylbutan-2-yl]glycinamide
- (s)-benzyl 2-(2-(4-chloro-3-oxo-1-phenylbutan-2-ylamino)-2-oxoethylamino)-2-oxoethylcarbamate
show 8 synonym(s)
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| DrugBank: - |
ChEMBL: - |
| Canonical SMILES: c1ccccc1C[C@@H](C(=O)CCl)NC(=O)CNC(=O)CNC(=O)OCc2ccccc2 |
| Standard InChI: InChI=1S/C22H24ClN3O5/c23-12-19(27)18(11-16-7-3-1-4-8-16)26-21(29)14-24-20(28)13-25-22(30)31-15-17-9-5-2-6-10-17/h1-10,18H,11-15H2,(H,24,28)(H,25,30)(H,26,29)/t18-/m0/s1 |
| Molecular Formula: C22H24ClN3O5 |
Mol. Weight: 445.14044 |
logP: 1.5644 |
| HBD: 3 | HBA: 5 |
| #Rotatable Bonds: 11 | TPSA: 113.6 |