UCSF

ZINC69698616

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2011 22 Yes

Popular Name: 5-[[4-(2,1-benzothiazol-3-yl)piperazin-1-yl]methyl]-3-methyl-1,2,4-oxadiazole 5-[[4-(2,1-benzothiazol-3-yl)pip…

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) 1.97 3.85 -10.61 0 6 0 58 315.402 3 ↓
Mid Mid (pH 6-8) 1.97 6.07 -52.94 1 6 1 59 316.41 3 ↓

Activity (Go SEA)

Rings

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

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