UCSF

ZINC70336256

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2011 20 Yes

Popular Name: (2S)-3-(3-azaspiro[5.5]undecan-3-yl)-2-cyclopropyl-2-(methylamino)propan-1-ol (2S)-3-(3-azaspiro[5.5]undecan-3…

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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) 2.82 7.08 -28.79 3 3 1 37 281.464 5 ↓
Mid Mid (pH 6-8) 2.82 6.5 -110.84 4 3 2 41 282.472 5 ↓

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

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