COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK773162
Chemical Name: ethyl4-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-6-(3-methoxyphenyl)-2-oxocyclohex-3-ene-1-carboxylate
Smiles: CCOC(=O)C1C(=O)C=C(CC1c1cccc(c1)OC)Nc1sc2c(c1C#N)CCCC2

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Molecular Weight: 450.56
Empirical Formula: C25H26N2O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.318
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 116
Number of rings: 4

     

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