UCSF

ZINC41476842

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 24 Yes

Popular Name: 1-(2-fluorophenyl)-3-methyl-4-(4-methylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidine 1-(2-fluorophenyl)-3-methyl-4-(4…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.03 11.48 -49.22 1 6 1 51 327.387 2 ↓
Mid Mid (pH 6-8) 2.03 9.12 -11.02 0 6 0 50 326.379 2 ↓

Activity (Go SEA)

Rings

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