UCSF

ZINC69564422

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 26th, 2011 24 Yes

Popular Name: 2-(6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide 2-(6,8-dihydro-5H-pyrido[3,4-d]p…

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) 2.23 6.47 -21.36 1 6 0 71 339.424 3 ↓
Mid Mid (pH 6-8) 2.23 8.66 -59.57 2 6 1 72 340.432 3 ↓

Activity (Go SEA)

Rings

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

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