UCSF

ZINC02126626

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 27 Yes

Popular Name: 3-(3-carboxylato-2-hydroxy-5-isopropyl-benzyl)-2-hydroxy-5-isopropyl-benzoate 3-(3-carboxylato-2-hydroxy-5-iso…

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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) 6.18 0.01 -112.09 2 6 -2 120 370.401 6 ↓

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