COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK451463
Chemical Name: propan-2-yl2-{[(phenylsulfanyl)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CC(OC(=O)c1c(NC(=O)CSc2ccccc2)sc2c1CCCCC2)C

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Molecular Weight: 403.57
Empirical Formula: C21H25NO3S2

Physical State: Dry powder
Available Amount: 698 mg

Lipinsky:
logP: 6.949
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 108
Number of rings: 3

     

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