UCSF

ZINC41588095

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 29 No

Popular Name: N-[[2-[(4-ethylpiperazin-1-yl)methyl]phenyl]methyl]-N'-(4-fluorophenyl)oxamide N-[[2-[(4-ethylpiperazin-1-yl)me…

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) 1.81 8.22 -34.08 3 6 1 66 399.49 7 ↓
Mid Mid (pH 6-8) 1.81 7.71 -36.69 3 6 1 66 399.49 7 ↓
Mid Mid (pH 6-8) 1.81 5.93 -5.29 2 6 0 65 398.482 7 ↓

Activity (Go SEA)

Rings

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