UCSF

ZINC02386870

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 21 Yes

Popular Name: Boc-D-phe(2,4-Cl2)-OH Boc-D-phe(2,4-Cl2)-OH

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CAS Numbers: 114873-04-0 , 114873-12-0 , 114873-2-0

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) 3.80 -0.07 -51.71 1 5 -1 78 333.191 6 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 133-137? Alfa-Aesar
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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