COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK623079
Chemical Name: 6-{[(1-benzylpiperidin-4-yl)ammonio]methyl}-8-chloro-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-olate
Smiles: Clc1cc2c(c(c1[O-])C[NH2+]C1CCN(CC1)Cc1ccccc1)oc(=O)c1c2CCC1

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Saltdata: HCl
Molecular Weight: 438.95
Empirical Formula: C25H27ClN2O3

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 4.958
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 69
Number of rings: 5

     

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