UCSF

ZINC67443605

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 9th, 2011 27 Yes

Popular Name: N-[(1R)-1,5-dimethylhexyl]-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)-1-piperidyl]acetamide N-[(1R)-1,5-dimethylhexyl]-2-[4-…

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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) 3.64 12.22 -54.97 2 6 1 64 372.537 8 ↓
Hi High (pH 8-9.5) 3.64 10.03 -21.1 1 6 0 63 371.529 8 ↓

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

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