UCSF

ZINC04023563

Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2005 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) 3.04 8.83 -11.51 0 2 0 34 284.399 0

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0004913A1; EP0008214A1; EP0015308A1; EP0127294A1; EP0286578A1; EP0289450A1; US3994938; US4029549; US4039381; US4042459; US4062729; US4062880; US4097335; US4098647; US4176123; US4177106; US4211841; US4293644; US4293645; US4293646; US4304860; US4320195; U IBM Patent Data

Activity (Go SEA)

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