UCSF

ZINC69769270

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 30th, 2011 19 Yes

Popular Name: 3-furyl-[3-(methylamino)-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-6-yl]methanone 3-furyl-[3-(methylamino)-7,8-dih…

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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) 0.12 3.48 -36.5 2 6 1 73 259.289 2 ↓
Mid Mid (pH 6-8) 0.12 3.36 -15.36 1 6 0 71 258.281 2 ↓
Mid Mid (pH 6-8) 0.12 3.54 -37.93 2 6 1 73 259.289 2 ↓

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Rings

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

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