UCSF

ZINC04198743

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2005 26 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) 5.65 2.7 -6.41 0 2 0 17 358.872 5

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Purity 97% Matrix Scientific
PUBCHEM_PATENT_ID EP0194984A1; EP0304910A1; EP0306323A2; EP0349949A2; EP0349949B1; EP0369743A2; EP0369743B1; EP0506982A1; EP0533243A1; EP0533243B1; EP0540051A1; EP0540051B1; EP0618913A1; EP0618913B1; EP0619818A1; EP0619818B1; EP0624584A1; EP0624584B1; EP0679084A1; EP071489 IBM Patent Data
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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