UCSF

ZINC00120558

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 21 No

Popular Name: 2-Oxo-2-phenylethyl 2-(4-(bromomethyl)phenyl)acetate 2-Oxo-2-phenylethyl 2-(4-(bromom…

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CAS Numbers: 66270-97-1 , 7398-42-7

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) 3.83 2.54 -10.15 0 3 0 43 347.208 7 ↓

Vendor Notes

Note Type Comments Provided By
MP 84-87 °C(lit.) Indofine
MP 88 TCI
Purity 95% Fluorochem

Activity (Go SEA)

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

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