UCSF

ZINC41580228

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: 5,6-dimethyl-2-piperazin-1-yl-thieno[2,3-d]pyrimidin-4-amine 5,6-dimethyl-2-piperazin-1-yl-th…

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) 1.76 6.38 -46.11 4 5 1 72 264.378 1 ↓
Hi High (pH 8-9.5) 1.76 5.11 -9.14 3 5 0 67 263.37 1 ↓
Lo Low (pH 4.5-6) 1.76 6.73 -87.79 5 5 2 73 265.386 1 ↓

Activity (Go SEA)

Rings

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

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