COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK626434
Chemical Name: 6-{[(4-chloro-2,5-dimethoxyphenyl)ammonio]methyl}-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-olate
Smiles: COc1cc(Cl)c(cc1[NH2+]Cc1c([O-])ccc2c1oc(=O)c1c2CCC1)OC

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Saltdata: HCl
Molecular Weight: 401.85
Empirical Formula: C21H20ClNO5

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 4.684
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 84
Number of rings: 4

     

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