UCSF

ZINC06623656

Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2006 21 No

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) 3.43 -0.39 -5.52 1 2 0 37 290.447 0

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0528906B1; EP0562843A3; EP0562843B1; EP0637203A1; EP0786999A1; US4013688; US4092413; US4097334; US4150126; US4252798; US4265816; US4297350; US4383992; US4522831; US5100882; US5206008; US5272134; US5277907; US5278141; US5461042; US5486603; US5604214; US5 IBM Patent Data

Activity (Go SEA)

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