UCSF

ZINC55107473

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2010 25 Yes

Popular Name: 2-[1-[[1-(2,1,3-benzoxadiazol-5-ylmethyl)-4-piperidyl]methyl]triazol-4-yl]ethanol 2-[1-[[1-(2,1,3-benzoxadiazol-5-…

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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) 1.78 4.95 -67.04 2 8 1 94 343.411 6 ↓
Hi High (pH 8-9.5) 1.78 2.68 -16.99 1 8 0 93 342.403 6 ↓

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

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