UCSF

ZINC04097908

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2005 22 Yes

Popular Name: ISOPIMARIC ACID ISOPIMARIC ACID

Find On: PubMed — Wikipedia — Google

CAS Number: 5835-26-7

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) 4.96 11.41 -51.43 0 2 -1 40 301.45 2 ↓
Lo Low (pH 4.5-6) 4.96 9.4 -5.38 1 2 0 37 302.458 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0011960A1; EP0013333A1; EP0045567A1; EP0048071A1; EP0225465A1; EP0341956A2; EP0341956B1; EP0363302A2; EP0363302B1; EP0457048A1; EP0475105A1; EP0526541A1; EP0526541B1; EP0567000A1; EP0567000B1; EP0572680B1; EP0585717B1; EP0644808A1; EP0661588A3; EP066158 IBM Patent Data

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