UCSF

ZINC04949939

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 12th, 2006 27 Yes

Popular Name: 1,3-dimethyl-8-piperazin-1-yl-7-(p-tolylmethyl)purine-2,6-dione 1,3-dimethyl-8-piperazin-1-yl-7-…

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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) 1.82 -2.83 -58.62 2 8 1 81 369.449 3 ↓

Activity (Go SEA)

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