UCSF

ZINC54931102

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 9th, 2010 12 Yes

Popular Name: N-methyl-7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine N-methyl-7,8-dihydro-5H-pyrano[4…

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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) 0.77 1.38 -9.02 1 4 0 47 165.196 1 ↓
Mid Mid (pH 6-8) 0.77 1.56 -27.43 2 4 1 48 166.204 1 ↓
Mid Mid (pH 6-8) 0.77 1.49 -26.98 2 4 1 48 166.204 1 ↓

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

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