UCSF

ZINC22007291

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2008 22 No

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Annotations

Vendors

    None

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) 3.14 6.9 -5.17 0 5 0 57 312.76 3

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US3954728; US3970664; US4044016; US4280957; US4307237; US4347364; US4347365; US4349475; US4349476; US4349477; US4368157; US4368158; US4368159; US4371468; US4376074; US4376075; US4377523; US4390471; US4401597; US4425272; US4440685 IBM Patent Data

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