COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK335328
Chemical Name: 9-(4-nitrophenyl)-2-[(pyridin-2-ylmethyl)sulfanyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: O=C1CCCC2=C1C(c1ccc(cc1)[N+](=O)[O-])n1c(N2)nc(n1)SCc1ccccn1

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Molecular Weight: 434.48
Empirical Formula: C21H18N6O3S

Physical State: Dry powder
Available Amount: 370 mg

Lipinsky:
logP: 3.16
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 143
Number of rings: 5

     

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