COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK570823
Chemical Name: 2-[14-(3,4-dimethoxyphenyl)-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3-ium-2-yl]phenolate
Smiles: COc1cc(ccc1OC)C1c2c(ccc3c2cccc3)Oc2c1c1nc([nH+]n1cn2)c1ccccc1[O-]

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Molecular Weight: 502.53
Empirical Formula: C30H22N4O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.824
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 95
Number of rings: 7

     

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