COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK472750
Chemical Name: methyl2-{[(2E)-2-cyano-3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)prop-2-enoyl]amino}-5-phenylthiophene-3-carboxylate
Smiles: N#C/C(=C\c1c(C)nn(c1C)CC)/C(=O)Nc1sc(cc1C(=O)OC)c1ccccc1

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Molecular Weight: 434.52
Empirical Formula: C23H22N4O3S

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 6.079
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 125
Number of rings: 3

     

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