COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK446803
Chemical Name: methyl6-tert-butyl-2-{[(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)/C=C/c2ccc(c(c2)OC)OC)sc2c1CCC(C2)C(C)(C)C

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Molecular Weight: 457.59
Empirical Formula: C25H31NO5S

Physical State: Dry powder
Available Amount: 364 mg

Lipinsky:
logP: 8.376
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 102
Number of rings: 3

     

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