COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK430189
Chemical Name: 6-{[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamoyl}cyclohex-3-ene-1-carboxylicacid
Smiles: CCC(C1CCc2c(C1)sc(c2C#N)NC(=O)C1CC=CCC1C(=O)O)(C)C

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Molecular Weight: 400.54
Empirical Formula: C22H28N2O3S

Physical State: Dry powder
Available Amount: 89 mg

Lipinsky:
logP: 5.107
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 118
Number of rings: 3

     

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