COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK471978
Chemical Name: 6-{[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylicacid
Smiles: CCC(C1CCc2c(C1)sc(c2C#N)NC(=O)C1CC(=C(CC1C(=O)O)C)C)(C)C

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Molecular Weight: 428.6
Empirical Formula: C24H32N2O3S

Physical State: Dry powder
Available Amount: 125 mg

Lipinsky:
logP: 6.288
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 118
Number of rings: 3

     

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