COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK617597
Chemical Name: 6-chloro-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-8-{[(pyridin-4-ylmethyl)ammonio]methyl}-2H-chromen-7-olate
Smiles: COC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2C[NH2+]Cc1ccncc1)[O-])Cl

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Saltdata: 2 HCl
Molecular Weight: 402.83
Empirical Formula: C20H19ClN2O5

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 3.203
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 105
Number of rings: 3

     

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