UCSF

ZINC52448761

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2010 22 Yes

Popular Name: 5-chloro-4-[[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylmethyl]thiadiazole 5-chloro-4-[[5-chloro-1-(2-metho…

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) 4.28 7.23 -7.51 0 5 0 53 375.306 6 ↓
Lo Low (pH 4.5-6) 4.28 7.69 -29.15 1 5 1 54 376.314 6 ↓

Activity (Go SEA)

Rings

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

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