UCSF

ZINC23368922

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 30th, 2008 21 Yes

Popular Name: 3-ethyl-5-(5-methyl-1,3-benzoxazol-2-yl)-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine 3-ethyl-5-(5-methyl-1,3-benzoxaz…

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) 3.16 5.7 -10.32 1 5 0 58 282.347 2 ↓
Lo Low (pH 4.5-6) 3.16 5.83 -35.41 2 5 1 59 283.355 2 ↓

Activity (Go SEA)

Rings

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

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