UCSF

ZINC40768938

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2010 16 Yes

Popular Name: (1R,5S)-N-allyl-7-isopropyl-7-azabicyclo[3.3.1]nonan-9-amine (1R,5S)-N-allyl-7-isopropyl-7-az…

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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) 2.94 7.92 -14.54 3 2 0 21 224.392 4 ↓
Hi High (pH 8-9.5) 2.94 6.85 -0.33 2 2 0 16 223.384 4 ↓

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Rings

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

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