UCSF

ZINC69977234

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2011 25 Yes

Popular Name: [3-(ethylamino)-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-6-yl]-[5-(2-furyl)-1H-pyrazol-3-yl]methanone [3-(ethylamino)-7,8-dihydro-5H-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) 1.46 4.84 -40.73 3 8 1 101 339.379 4 ↓
Mid Mid (pH 6-8) 1.46 5.07 -36.41 3 8 1 101 339.379 4 ↓
Mid Mid (pH 6-8) 1.46 4.91 -15.26 2 8 0 100 338.371 4 ↓

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

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