UCSF

ZINC52831513

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: N'-cyclopropyl-N-pyridazin-3-yl-propane-1,3-diamine N'-cyclopropyl-N-pyridazin-3-yl-…

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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) 0.61 3.74 -46.17 3 4 1 54 193.274 6 ↓
Mid Mid (pH 6-8) 0.61 3.9 -85.36 4 4 2 56 194.282 6 ↓
Mid Mid (pH 6-8) 0.61 3.92 -87.62 4 4 2 56 194.282 6 ↓

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Rings

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

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