UCSF

ZINC70094487

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2011 20 Yes

Popular Name: 2-[(6-methoxy-2-pyridyl)methyl]-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3-one 2-[(6-methoxy-2-pyridyl)methyl]-…

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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) 0.73 2.24 -61.45 2 6 1 74 273.316 3 ↓
Mid Mid (pH 6-8) 0.73 0.83 -13.2 1 6 0 69 272.308 3 ↓

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

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