UCSF

ZINC08294976

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 7th, 2006 10 Yes

Popular Name: 4-PYRIDINEPROPANOL 4-PYRIDINEPROPANOL

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CAS Numbers: 2629-72-3 , 7037-49-2 , [2629-72-3]

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) 0.71 1.6 -6.18 1 2 0 33 137.182 3 ↓
Lo Low (pH 4.5-6) 0.71 1.88 -32.63 2 2 1 34 138.19 3 ↓

Vendor Notes

Note Type Comments Provided By
BP 289 TCI
BP 289° Oakwood Chemical
MP 35-39° Oakwood Chemical
Purity 95% Fluorochem
Purity 97% Fluorochem
melting_point LMS KeyOrganics

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

No pre-computed analogs available. Try a structural similarity search.