COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK719262
Chemical Name: 4-chloro-3-{[(Z)-{5-cyano-4-methyl-2,6-dioxo-1-[3-(2-oxopyrrolidin-1-yl)propyl]-1,6-dihydropyridin-3(2H)-ylidene}methyl]amino}benzoicacid
Smiles: N#CC1=C(C)/C(=C/Nc2cc(ccc2Cl)C(=O)O)/C(=O)N(C1=O)CCCN1CCCC1=O

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Molecular Weight: 456.89
Empirical Formula: C22H21ClN4O5

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 1.766
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 130
Number of rings: 3

     

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