UCSF

ZINC52831550

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2010 15 Yes

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

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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) 0.74 4.31 -46.29 3 4 1 54 205.285 2 ↓
Mid Mid (pH 6-8) 0.74 4.47 -84.68 4 4 2 56 206.293 2 ↓
Mid Mid (pH 6-8) 0.74 4.48 -87.3 4 4 2 56 206.293 2 ↓

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

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