UCSF

ZINC62960946

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 20th, 2011 19 Yes

Popular Name: (2-amino-3-pyridyl)-(8-azaspiro[4.5]decan-8-yl)methanone (2-amino-3-pyridyl)-(8-azaspiro[…

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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) 1.33 5.74 -7.85 2 4 0 59 259.353 1 ↓
Lo Low (pH 4.5-6) 1.33 6.19 -35.79 3 4 1 60 260.361 1 ↓

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

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