UCSF

ZINC49512406

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2010 36 No

Popular Name: N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-N'-(oxoBLAHyl)oxamide N-[2-[4-(2-methoxyphenyl)piperaz…

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) 1.58 8.97 -51.51 3 9 1 95 492.6 7 ↓
Mid Mid (pH 6-8) 1.58 6.76 -13.63 2 9 0 94 491.592 7 ↓

Activity (Go SEA)

Rings

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

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