COVPDB

Ligand

Ligand Name: SNJ-1945
Ligand Type: non-polymer
Ligand ID: COVPDB677	PubChem: 6857712
Synonym(s): chembl475920 ((1s)-1-((((1s)-1-benzyl-3-(cyclopropylamino)-2,3-dioxopropyl)amino)carbonyl)-3-methylbutyl)carbamic acid 5-methoxy-3-oxapentyl ester ((1s)-1-((((1s)-1-benzyl-3-cyclopropylamino-2,3-di-oxopropyl)amino)carbonyl)-3-methylbutyl)carbamic acid 5-methoxy-3-oxapentyl ester 854402-59-8 schembl356129 snj1945 bdbm50263559 2-(2-methoxyethoxy)ethyl n-[(2s)-1-[[(2s)-4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate q27459105 2-(2-methoxyethoxy)ethyl (s)-1-((s)-4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-ylamino)-4-methyl-1-oxopentan-2-ylcarbamate n-[(1s)-1-benzyl-3-(cyclopropylamino)-2,3-dioxopropyl]-n~2~-{[2-(2-methoxyethoxy)ethoxy]carbonyl}-l-leucinamide show 10 synonym(s)
DrugBank: -	ChEMBL: CHEMBL475920
Canonical SMILES: COCCOCCOC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)C(=O)NC1CC1)Cc2ccccc2
Standard InChI: InChI=1S/C25H37N3O7/c1-17(2)15-21(28-25(32)35-14-13-34-12-11-33-3)23(30)27-20(16-18-7-5-4-6-8-18)22(29)24(31)26-19-9-10-19/h4-8,17,19-21H,9-16H2,1-3H3,(H,26,31)(H,27,30)(H,28,32)/t20-,21-/m0/s1
Molecular Formula: C25H37N3O7	Mol. Weight: 491.26315	logP: 1.3655
HBD: 3	HBA: 7
#Rotatable Bonds: 16	TPSA: 132.06