UCSF

ZINC00897612

Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2005 21 No

CAS Numbers: 38216-54-5 , 480-70-6

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) 1.47 -5.34 -14.33 4 6 0 111 286.239 1

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0496349B1; EP1001028A1; US5241022 IBM Patent Data
UniProt Database Links I7GT1_SOYBN ChEBI
Patent Database Links WO2007121916 ChEBI

Activity (Go SEA)

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