COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK293294
Chemical Name: N-[2-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]-3-nitro-4-(pyrrolidin-1-yl)benzamide
Smiles: O=C(c1ccc(c(c1)[N+](=O)[O-])N1CCCC1)Nc1ccccc1c1sc2n(n1)c(nn2)C

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Molecular Weight: 449.49
Empirical Formula: C21H19N7O3S

Physical State: Dry powder
Available Amount: 106 mg

Lipinsky:
logP: 5.543
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 149
Number of rings: 5

     

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