UCSF

ZINC58312662

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2011 24 Yes

Popular Name: N-[[(2R)-4-benzylmorpholin-2-yl]methyl]-[1,2,4]triazolo[3,4-f]pyridazin-6-amine N-[[(2R)-4-benzylmorpholin-2-yl]…

Find On: PubMed — Wikipedia — Google

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) 1.50 6.96 -12.88 1 7 0 68 324.388 5 ↓
Lo Low (pH 4.5-6) 1.50 9.22 -53.29 2 7 1 69 325.396 5 ↓

Activity (Go SEA)

Rings

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

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