COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK773147
Chemical Name: methyl4-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxo-6-phenylcyclohex-3-ene-1-carboxylate
Smiles: COC(=O)C1C(=O)C=C(CC1c1ccccc1)Nc1sc2c(c1C#N)CCCC2

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Molecular Weight: 406.51
Empirical Formula: C23H22N2O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.871
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 4

     

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