UCSF

ZINC26248383

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2009 53 No

Popular Name: 1-cyclopropyl-7-[4-[[4-[[4-(1-cyclopropyl-6-fluoro-4-oxo-7-quinolyl)piperazin-1-yl]methyl]phenyl]met 1-cyclopropyl-7-[4-[[4-[[4-(1-cy…

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) 0.83 21.62 -111.39 1 10 0 98 720.821 9 ↓
Mid Mid (pH 6-8) 0.83 21.62 -121.73 1 10 0 98 720.821 9 ↓
Mid Mid (pH 6-8) 0.83 19.4 -78.4 0 10 -1 97 719.813 9 ↓
Lo Low (pH 4.5-6) 0.83 21.82 -136.41 3 10 2 97 722.837 9 ↓

Activity (Go SEA)

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