UCSF

ZINC12009725

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2008 32 No

Popular Name: N-[5-(2-furyl)-2-(4-oxo-3,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-yl)pyrazol-3-yl]-4-nitro-benzamid N-[5-(2-furyl)-2-(4-oxo-3,5,6,7-…

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) 2.59 11.07 -37.43 2 11 0 152 432.396 5 ↓
Mid Mid (pH 6-8) 2.59 11.97 -17.11 2 11 0 152 432.396 5 ↓
Mid Mid (pH 6-8) 3.05 10.75 -54.68 1 11 -1 155 431.388 5 ↓

Activity (Go SEA)

Rings

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

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