UCSF

ZINC62952157

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Substance Information

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

Popular Name: [3-(aminomethyl)phenyl]-(8-azaspiro[4.5]decan-8-yl)methanone [3-(aminomethyl)phenyl]-(8-azasp…

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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) 1.95 6.55 -48.45 3 3 1 48 273.4 2 ↓
Hi High (pH 8-9.5) 1.95 6.15 -7.87 2 3 0 46 272.392 2 ↓

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

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