COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK723631
Chemical Name: 1-(3-nitro-4-{[5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}phenyl)ethanone
Smiles: C=CCn1c2ccccc2c2c1nc(nn2)Sc1ccc(cc1[N+](=O)[O-])C(=O)C

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Molecular Weight: 405.44
Empirical Formula: C20H15N5O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.578
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 131
Number of rings: 4

     

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