COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL516950
Chemical Name: 6-(azepanium-1-ylmethyl)-4,7-dimethyl-2-oxo-2H-chromen-5-olate
Smiles: O=c1cc(C)c2c(o1)cc(c(c2[O-])C[NH+]1CCCCCC1)C

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Molecular Weight: 301.39
Empirical Formula: C18H23NO3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.18
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 53
Number of rings: 3

     

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