COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK123685
Chemical Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-{[5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c2ccccc2c2c1nc(SCC(=O)Nc1nc3c(s1)cc(cc3)[N+](=O)[O-])nn2

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Molecular Weight: 477.53
Empirical Formula: C21H15N7O3S2

Physical State: Dry powder
Available Amount: 337 mg

Lipinsky:
logP: 4.491
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 184
Number of rings: 5

     

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