UCSF

ZINC67239863

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 7th, 2011 24 Yes

Popular Name: N-methyl-1-phenyl-N-[[6-(2-pyridyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl]methanamine N-methyl-1-phenyl-N-[[6-(2-pyrid…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.24 7.61 -12.62 0 6 0 59 336.424 5 ↓
Mid Mid (pH 6-8) 2.24 9.91 -44.17 1 6 1 60 337.432 5 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.