COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK704873
Chemical Name: (2E)-3-[2-(2-chlorophenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-[(4-methylphenyl)sulfonyl]prop-2-enenitrile
Smiles: N#C/C(=C\c1c(Oc2ccccc2Cl)nc2n(c1=O)cccc2C)/S(=O)(=O)c1ccc(cc1)C

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Molecular Weight: 491.95
Empirical Formula: C25H18ClN3O4S

Physical State: Dry powder
Available Amount: 402 mg

Lipinsky:
logP: 4.21
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 108
Number of rings: 4

     

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