UCSF

ZINC41590645

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 27 Yes

Popular Name: N-isopropyl-3-[4-(2-pyridyl)piperazine-1-carbonyl]benzenesulfonamide N-isopropyl-3-[4-(2-pyridyl)pipe…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

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) 1.31 5.86 -48.11 2 7 1 84 389.501 5 ↓
Mid Mid (pH 6-8) 1.31 5.6 -19.59 1 7 0 83 388.493 5 ↓

Activity (Go SEA)

Rings

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

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