UCSF

ZINC67443530

Draw Identity 99% 90% 80% 70%

Substance Information

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

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

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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) 3.50 13.68 -54.86 1 6 1 55 372.537 9 ↓
Hi High (pH 8-9.5) 3.50 11.48 -21.07 0 6 0 54 371.529 9 ↓

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

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