UCSF

ZINC00000048

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 16 Yes

Popular Name: apiole apiole

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CAS Number: 523-80-8

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) 2.42 3.78 -8.68 0 4 0 37 222.24 4 ↓

Vendor Notes

Note Type Comments Provided By
Therapy antipyretic, diuretic, insecticide SMDC MicroSource

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