COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK374892
Chemical Name: ethyl2-[({(2E)-3-[4-(propan-2-yl)phenyl]prop-2-enoyl}carbamothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)/C=C/c2ccc(cc2)C(C)C)sc2c1CCCC2

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Molecular Weight: 456.63
Empirical Formula: C24H28N2O3S2

Physical State: Dry powder
Available Amount: 180 mg

Lipinsky:
logP: 8.761
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 127
Number of rings: 3

     

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