UCSF

ZINC35454108

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2009 29 Yes

Popular Name: (3,5-dichlorophenyl)-[4-(4-ethylpiperazin-1-yl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl] (3,5-dichlorophenyl)-[4-(4-ethyl…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 2.67 11.57 -45.59 1 6 1 54 435.379 3 ↓
Mid Mid (pH 6-8) 2.67 11.98 -92.18 2 6 2 55 436.387 3 ↓
Mid Mid (pH 6-8) 2.67 9.35 -7.83 0 6 0 53 434.371 3 ↓

Activity (Go SEA)

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