COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK677318
Chemical Name: N-[(1Z)-3-(2-chlorophenyl)-1-({2-[(4-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-2-cyano-5-oxo-5-phenylpent-1-en-1-yl]benzamide
Smiles: N#C/C(=C(/NC(=O)c1ccccc1)\SCC(=O)Nc1ccc(cc1)Cl)/C(c1ccccc1Cl)CC(=O)c1ccccc1

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Molecular Weight: 614.55
Empirical Formula: C33H25Cl2N3O3S

Physical State: Dry powder
Available Amount: 210 mg

Lipinsky:
logP: 9.064
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 124
Number of rings: 4

     

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