UCSF

ZINC54763583

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 7th, 2010 18 Yes

Popular Name: N-(1H-imidazol-5-ylmethyl)-2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanamine N-(1H-imidazol-5-ylmethyl)-2-([1…

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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) 0.46 6.03 -45.92 3 6 1 72 243.294 5 ↓
Mid Mid (pH 6-8) 0.46 5.55 -17.92 2 6 0 71 242.286 5 ↓

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

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