COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK186485
Chemical Name: (2Z)-2-cyano-3-[1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2,5-dimethyl-1H-pyrrol-3-yl]-N-(3-ethoxyphenyl)prop-2-enamide
Smiles: CCOc1cccc(c1)NC(=O)/C(=C\c1cc(n(c1C)c1sc2c(c1C#N)CCCC2)C)/C#N

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Molecular Weight: 470.6
Empirical Formula: C27H26N4O2S

Physical State: Dry powder
Available Amount: 330 mg

Lipinsky:
logP: 6.557
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 119
Number of rings: 4

     

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