UCSF

ZINC67966784

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2011 27 Yes

Popular Name: 6-(1-oxa-7-azaspiro[3.5]nonan-7-yl)-N-[3-(2-pyridyl)propyl]pyridine-3-carboxamide 6-(1-oxa-7-azaspiro[3.5]nonan-7-…

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Download: MOL2 SDF SMILES Flexibase

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) 1.82 7.45 -11.83 1 6 0 67 366.465 6 ↓
Lo Low (pH 4.5-6) 1.82 7.79 -40.67 2 6 1 69 367.473 6 ↓

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Rings

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

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