UCSF

ZINC43524017

Substance Information

In ZINC since Heavy atoms Benign functionality
May 15th, 2010 21 No

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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) 8.26 14.81 -4.08 0 2 0 26 298.511 17

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0180630A1; EP0180630B2; EP0189377A2; EP0328158A1; EP0328158B1; EP0637910B1; EP0639047A1; EP0639047B1; EP0659582B1; EP0708153A1; EP0873881A1; EP0908501A1; EP1022726A1; US4147800; US4364743; US4579778; US4772522; US4886656; US5100697; US5558700; US5873932 IBM Patent Data

Activity (Go SEA)

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