UCSF

ZINC19453611

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2008 29 Yes

Popular Name: 7-[(3,5-dimethoxyphenyl)methyl]-2-isopropyl-4-pyrrolidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine 7-[(3,5-dimethoxyphenyl)methyl]-…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 3.46 10.37 -107.29 2 6 2 53 398.551 6 ↓
Hi High (pH 8-9.5) 3.46 7.69 -9.67 0 6 0 51 396.535 6 ↓
Hi High (pH 8-9.5) 3.46 8.05 -27.75 1 6 1 52 397.543 6 ↓
Mid Mid (pH 6-8) 3.46 10.02 -47.35 1 6 1 52 397.543 6 ↓

Activity (Go SEA)

Rings

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