UCSF

ZINC52831416

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2010 11 Yes

Popular Name: N-[(1S,2R)-2-methylcyclopropyl]pyridazin-3-amine N-[(1S,2R)-2-methylcyclopropyl]p…

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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) 1.17 3.82 -7.61 1 3 0 38 149.197 2 ↓
Mid Mid (pH 6-8) 1.17 3.99 -27.87 2 3 1 39 150.205 2 ↓
Mid Mid (pH 6-8) 1.17 4 -31.69 2 3 1 39 150.205 2 ↓

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Rings

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

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