COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK700966
Chemical Name: 2-methyl-3-(4-nitrophenyl)-4-oxo-4H-chromen-7-ylN-[(4-methylphenyl)sulfonyl]-beta-alaninate
Smiles: O=C(Oc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)[N+](=O)[O-])C)CCNS(=O)(=O)c1ccc(cc1)C

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Molecular Weight: 522.54
Empirical Formula: C26H22N2O8S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.804
Rotatable bonds: 5
H-donors: 1
H-acceptors: 8
PSA: 152
Number of rings: 4

     

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