UCSF

ZINC00156918

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 14 Yes

Popular Name: 3-(4-Hydroxymethylphenoxy)propionic acid 3-(4-Hydroxymethylphenoxy)propio…

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CAS Number: 101366-61-4

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) 0.85 1.88 -46.4 1 4 -1 70 195.194 5 ↓

Vendor Notes

Note Type Comments Provided By
MP 148-152 °C Indofine

Activity (Go SEA)

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