COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK457542
Chemical Name: methyl2-{[(2-{4-[(2-chlorophenyl)amino]-4-oxobutanoyl}hydrazinyl)carbonothioyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)NNC(=O)CCC(=O)Nc2ccccc2Cl)sc2c1CCCCCC2

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Molecular Weight: 523.08
Empirical Formula: C23H27ClN4O4S2

Physical State: Dry powder
Available Amount: 443 mg

Lipinsky:
logP: 6.48
Rotatable bonds: 6
H-donors: 4
H-acceptors: 4
PSA: 168
Number of rings: 3

     

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