COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK742509
Chemical Name: 2-(3-{(E)-[(2Z)-3-cyclohexyl-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: N#Cc1c(sc2c1CCCC2)n1c(C)cc(c1C)/C=C\1/S/C(=N\C2CCCCC2)/N(C1=O)C1CCCCC1

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Molecular Weight: 546.8
Empirical Formula: C31H38N4OS2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.861
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 114
Number of rings: 6

     

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