UCSF

ZINC52831499

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2010 13 Yes

Popular Name: (1S,5R)-N-pyridazin-3-yl-3-azabicyclo[3.1.0]hexan-6-amine (1S,5R)-N-pyridazin-3-yl-3-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) 0.67 2.68 -44.05 3 4 1 54 177.231 2 ↓
Mid Mid (pH 6-8) 0.67 2.84 -86.03 4 4 2 56 178.239 2 ↓
Mid Mid (pH 6-8) 0.67 2.85 -89.99 4 4 2 56 178.239 2 ↓

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Rings

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

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