COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK597943
Chemical Name: 8,8-dimethyl-3-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-5-(phenylamino)-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
Smiles: N#Cc1c(Nc2ccccc2)n2c(SCC(=O)c3ccc(cc3)[N+](=O)[O-])nnc2c2c1CC(C)(C)OC2

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Molecular Weight: 514.56
Empirical Formula: C26H22N6O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.602
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 163
Number of rings: 5

     

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