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| Ligand Name: 1,5-BIS(N-BENZYLOXYCARBONYL-L-LEUCINYL)CARBOHYDRAZIDE |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB953 |
PubChem:
5288634
|
Synonym(s):
- chembl115357
- bdbm50408519
- db03891
- dibenzyl (carbonylbis{2,1-hydrazinediyl[(2s)-4-methyl-1-oxo-1,2-pentanediyl]})biscarbamate
- benzyl [(1s,9s)-1,9-bis(2-methylpropyl)-2,5,8,11-tetraoxo-13-phenyl-12-oxa-3,4,6,7,10-pentaazatridec-1-yl]carbamate (non-preferred name)
show 4 synonym(s)
|
| DrugBank: DB03891 |
ChEMBL: CHEMBL115357 |
| Canonical SMILES: c1ccccc1COC(=O)N[C@@H](CC(C)C)C(=O)NNC(=O)NNC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2 |
| Standard InChI: InChI=1S/C29H40N6O7/c1-19(2)15-23(30-28(39)41-17-21-11-7-5-8-12-21)25(36)32-34-27(38)35-33-26(37)24(16-20(3)4)31-29(40)42-18-22-13-9-6-10-14-22/h5-14,19-20,23-24H,15-18H2,1-4H3,(H,30,39)(H,31,40)(H,32,36)(H,33,37)(H2,34,35,38)/t23-,24-/m0/s1 |
| Molecular Formula: C29H40N6O7 |
Mol. Weight: 584.29584 |
logP: 3.0302 |
| HBD: 6 | HBA: 7 |
| #Rotatable Bonds: 12 | TPSA: 175.99 |