UCSF

ZINC14966421

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2008 37 No

Popular Name: 1,3-O-Dicaffeoylquinic acid 1,3-O-Dicaffeoylquinic acid

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CAS Numbers: 19870-46-3 , 30964-13-7 , [19870-46-3]

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) 1.42 0.89 -66.83 6 12 -1 214 515.447 9 ↓

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