COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL039888
Chemical Name: 3-benzyl-6-chloro-4-methyl-2-oxo-8-(pyrrolidinium-1-ylmethyl)-2H-chromen-7-olate
Smiles: O=c1oc2c(C[NH+]3CCCC3)c([O-])c(cc2c(c1Cc1ccccc1)C)Cl

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Molecular Weight: 383.87
Empirical Formula: C22H22ClNO3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.341
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 53
Number of rings: 4

     

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