UCSF

ZINC04170971

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2005 29 Yes

Popular Name: N-[(4-methoxyphenyl)methyl]-2-(methylBLAHyl)sulfanyl-acetamide N-[(4-methoxyphenyl)methyl]-2-(m…

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) 3.30 -2.47 -12.71 1 6 0 69 410.495 6 ↓
Lo Low (pH 4.5-6) 3.30 -2.33 -35.34 2 6 1 70 411.503 6 ↓

Activity (Go SEA)

Rings

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

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