COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL181245
Chemical Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(3-nitrophenyl)[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide
Smiles: N#Cc1c(sc2c1CCCC2)NC(=O)c1cc(nc2n1ncn2)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 445.46
Empirical Formula: C21H15N7O3S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 2.906
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 170
Number of rings: 5

     

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