UCSF

ZINC13424753

Substance Information

In ZINC since Heavy atoms Benign functionality
June 19th, 2008 25 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 1.05 2.75 -13.54 3 5 0 87 350.455 3

Vendor Notes

Note Type Comments Provided By
M.P 225-226 C Indofine Natural Products
M.P 229-232 °C Indofine Natural Products
SOLUBILITY Paniculata leaves Indofine Natural Products
APPEARANCE Terepenoid Lactone from Andrographis Indofine Natural Products

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

No pre-computed analogs available. Try a structural similarity search.