UCSF

ZINC19450809

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2008 26 Yes

Popular Name: (1R,5S)-7-[(3-isopropoxyphenyl)methyl]-9-morpholino-7-azabicyclo[3.3.1]nonane (1R,5S)-7-[(3-isopropoxyphenyl)m…

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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) 3.89 9.7 -28.71 1 4 0 26 359.534 5 ↓
Mid Mid (pH 6-8) 3.89 11.57 -104.17 2 4 2 27 360.542 5 ↓

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

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