COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK472030
Chemical Name: 6-{[3-carbamoyl-4-(3,4-dimethylphenyl)-5-methylthiophen-2-yl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylicacid
Smiles: O=C(C1CC(=C(CC1C(=O)O)C)C)Nc1sc(c(c1C(=O)N)c1ccc(c(c1)C)C)C

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Molecular Weight: 440.56
Empirical Formula: C24H28N2O4S

Physical State: Dry powder
Available Amount: 128 mg

Lipinsky:
logP: 5.224
Rotatable bonds: 5
H-donors: 4
H-acceptors: 4
PSA: 137
Number of rings: 3

     

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