COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL332085
Chemical Name: methyl2-{[(2Z)-2-cyano-3-phenylprop-2-enoyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: N#C/C(=C/c1ccccc1)/C(=O)Nc1sc2c(c1C(=O)OC)CCC(C2)C

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Molecular Weight: 380.47
Empirical Formula: C21H20N2O3S

Physical State: Dry powder
Available Amount: 160 mg

Lipinsky:
logP: 6.973
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 3

     

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