UCSF

ZINC01673523

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 11 No

Popular Name: 2-Chloro-1-(4-hydroxyphenyl)ethanone 2-Chloro-1-(4-hydroxyphenyl)etha…

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CAS Numbers: 6305-04-0 , 68301-59-7

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) 1.59 2.77 -9.11 1 2 0 37 170.595 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 142 - 144 Enamine Building Blocks
MP 142...144 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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

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