UCSF

ZINC41528019

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 18 Yes

Popular Name: 3-methyl-N-(4-pyridylmethyl)-1H-pyrazolo[4,3-d]pyrimidin-7-amine 3-methyl-N-(4-pyridylmethyl)-1H-…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

    None

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) 0.33 3.64 -8.44 2 6 0 79 240.27 3 ↓
Lo Low (pH 4.5-6) 0.33 4.48 -41.48 3 6 1 81 241.278 3 ↓

Activity (Go SEA)

Rings

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

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