COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK334819
Chemical Name: 9-(4-hydroxy-3-methoxy-5-nitrophenyl)-6-(thiophen-2-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: COc1cc(cc(c1O)[N+](=O)[O-])C1C2=C(CC(CC2=O)c2cccs2)Nc2n1ncn2

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Molecular Weight: 439.45
Empirical Formula: C20H17N5O5S

Physical State: Dry powder
Available Amount: 155 mg

Lipinsky:
logP: 2.703
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 163
Number of rings: 5

     

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