COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK454921
Chemical Name: (2Z)-3-[3-({[4-(difluoromethyl)-6-methylpyrimidin-2-yl]sulfanyl}methyl)-4-methoxyphenyl]-2-(phenylsulfonyl)prop-2-enenitrile
Smiles: COc1ccc(cc1CSc1nc(C)cc(n1)C(F)F)/C=C(\S(=O)(=O)c1ccccc1)/C#N

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Molecular Weight: 487.55
Empirical Formula: C23H19F2N3O3S2

Physical State: Dry powder
Available Amount: 440 mg

Lipinsky:
logP: 4.331
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 126
Number of rings: 3

     

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