UCSF

ZINC14421708

Substance Information

In ZINC since Heavy atoms Benign functionality
July 9th, 2008 20 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) 4.32 9.8 -4.74 0 1 0 17 272.432 0

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0562843A3; EP0562843B1; EP0659277B1; EP0783513A1; EP0804209A1; EP0830369A1; EP0891188A1; EP0948521A1; US4384206; US4670401; US4762819; US4879244; US4931403; US5155045; US5278141; US5372822; US5380765; US5492934; US5604214; US5922699; US5962443; US610703 IBM Patent Data

Activity (Go SEA)

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