UCSF

ZINC68954774

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: (1R,5S)-N-cyclobutyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine (1R,5S)-N-cyclobutyl-N-propyl-8-…

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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) 2.43 7.05 -94.31 3 2 2 21 224.392 4 ↓
Mid Mid (pH 6-8) 2.43 5.93 -27.13 2 2 1 16 223.384 4 ↓
Mid Mid (pH 6-8) 2.43 7.15 -32.77 2 2 1 20 223.384 4 ↓

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

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