COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK006730
Chemical Name: (2E)-3-(5-bromo-2,4-dimethoxyphenyl)-2-cyano-N-(thiophen-2-ylmethyl)prop-2-enamide
Smiles: N#C/C(=C\c1cc(Br)c(cc1OC)OC)/C(=O)NCc1cccs1

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Molecular Weight: 407.29
Empirical Formula: C17H15BrN2O3S

Physical State: Dry powder
Available Amount: 385 mg

Lipinsky:
logP: 3.499
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 99
Number of rings: 2

     

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