COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK619917
Chemical Name: 3-(2-methoxy-2-oxoethyl)-4,8-dimethyl-2-oxo-6-{[(pyridin-4-ylmethyl)ammonio]methyl}-2H-chromen-7-olate
Smiles: COC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2C)[O-])C[NH2+]Cc1ccncc1

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Saltdata: HCl
Molecular Weight: 382.42
Empirical Formula: C21H22N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.86
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 105
Number of rings: 3

     

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