COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK438064
Chemical Name: ethyl2-{[(2E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino}-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)/C=C/c2ccc3c(c2)OCO3)sc(c1C)C(=O)N(C)C

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Molecular Weight: 430.48
Empirical Formula: C21H22N2O6S

Physical State: Dry powder
Available Amount: 455 mg

Lipinsky:
logP: 5.738
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 122
Number of rings: 3

     

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