UCSF

ZINC60119425

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2011 31 No

Popular Name: 2-[1-[[(2R)-2-(4-chlorophenoxy)propoxy]amino]propylidene]-5-[(1S,6S)-4,7-dioxabicyclo[4.1.0]heptan-1 2-[1-[[(2R)-2-(4-chlorophenoxy)p…

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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) 3.34 8.31 -13.74 1 7 0 86 449.931 8 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US6107254 IBM Patent Data

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

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