COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL079608
Chemical Name: 4-{[5,6-dimethyl-4-oxo-3-(prop-2-en-1-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]butanamide
Smiles: C=CCn1c(SCCCC(=O)Nc2ccccc2C(F)(F)F)nc2c(c1=O)c(C)c(s2)C

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Molecular Weight: 481.56
Empirical Formula: C22H22F3N3O2S2

Physical State: Dry powder
Available Amount: 93 mg

Lipinsky:
logP: 4.206
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 115
Number of rings: 3

     

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