UCSF

ZINC22750176

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 35 Yes

Popular Name: 2-(2-chloro-4,6-dimethyl-phenoxy)-N-[2-(4-diethylaminophenyl)-6-methyl-benzotriazol-5-yl]acetamide 2-(2-chloro-4,6-dimethyl-phenoxy…

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) 6.13 14.29 -57.57 2 7 0 73 493.031 8 ↓
Mid Mid (pH 6-8) 6.13 14.16 -20.51 1 7 0 72 492.023 8 ↓

Activity (Go SEA)

Rings

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

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