UCSF

ZINC62953699

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 20th, 2011 16 Yes

Popular Name: N-[2-(8-azaspiro[4.5]decan-8-yl)ethyl]cyclopropanamine N-[2-(8-azaspiro[4.5]decan-8-yl)…

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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) 2.38 8.25 -113.15 3 2 2 21 224.392 4 ↓
Hi High (pH 8-9.5) 2.38 6.02 -34.76 2 2 1 20 223.384 4 ↓
Hi High (pH 8-9.5) 2.38 6.96 -34.2 2 2 1 16 223.384 4 ↓

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

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