UCSF

ZINC02913599

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 5th, 2004 15 Yes

Popular Name: 3-(4-propoxyphenyl)propanoic acid 3-(4-propoxyphenyl)propanoic acid

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CAS Number: 3243-40-1

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) 2.82 7.66 -44.21 0 3 -1 49 207.249 6 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks
MP 90 - 92 Enamine Building Blocks
MP 90...92 Enamine Building Blocks
Melting_Point 94-99? Alfa-Aesar
Melting_Point 94-99° Alfa-Aesar
purity 95 Enamine Building Blocks

Activity (Go SEA)

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