UCSF

ZINC54931051

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 9th, 2010 15 Yes

Popular Name: N-methyl-5H-indeno[1,2-c]pyridazin-3-amine N-methyl-5H-indeno[1,2-c]pyridaz…

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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) 2.35 5.39 -11.46 1 3 0 38 197.241 1 ↓
Lo Low (pH 4.5-6) 2.35 5.56 -28.45 2 3 1 39 198.249 1 ↓
Lo Low (pH 4.5-6) 2.35 5.53 -24.87 2 3 1 39 198.249 1 ↓

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Rings

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

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