UCSF

ZINC44608348

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2010 10 Yes

Other Names:

Tyvelose

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) -1.15 -5.24 -4.86 3 4 0 70 148.158 0

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 8.48e+02 g/l DrugBank-experimental
PUBCHEM_PATENT_ID EP0576439B1; EP0875759A2; EP0875759A3; EP0886143A1; EP0965344A1; EP1005537A1; US4894229; US5180674; US5288637; US5541075; US5653986; US5686256; US5707817; US5807694; US5874261; US5879912; US6054047; US6143526; US6143725; WO1992016624A1; WO1993013198A1; WO IBM Patent Data

Activity (Go SEA)

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