UCSF

ZINC03938705

Substance Information

In ZINC since Heavy atoms Benign functionality
October 21st, 2005 24 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) 2.56 5.05 -13.89 1 4 0 74 329.44 0

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0108606A1; EP0139608A2; EP0142309A2; EP0154476A2; EP0296097A2; EP0296097B1; EP0462189A1; EP0462189B1; EP0546164A1; EP0595796A1; EP0646008A1; EP0646008B1; EP0665009A1; EP0665009B1; EP0712293A1; EP0737066A1; EP0792152A1; EP0871441A1; EP0896819A1; EP090179 IBM Patent Data

Activity (Go SEA)

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