COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL055194
Chemical Name: (6E)-6-{[2,5-dimethyl-1-(2-methyl-5-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-5-imino-2-(pyridin-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: O=C1N=c2sc(nn2C(=N)/C/1=C\c1cc(n(c1C)c1cc(ccc1C)[N+](=O)[O-])C)c1cccnc1

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Molecular Weight: 485.53
Empirical Formula: C24H19N7O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.076
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 157
Number of rings: 5

     

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