UCSF

ZINC00135384

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 12 Yes

Download: MOL2 SDF SMILES Flexibase

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Vendors

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) -1.11 3.68 -53.43 1 4 -1 69 172.204 4

Vendor Notes

Note Type Comments Provided By
Melting_Point 146-149? Alfa-Aesar
Melting_Point 146-149° Alfa-Aesar
Melting_Point 159-161? Alfa-Aesar
Melting_Point 159-161° Alfa-Aesar
MP 160 TCI
MP 176-177C Indofine
Melting_Point 177-179? Alfa-Aesar
Melting_Point 177-179° Alfa-Aesar
MP 189-190° Matrix Scientific
Mp [°C] 190 Acros Organics
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 98% Fluorochem
Therapy antivertigo SMDC Pharmakon
Patent Database Links EP0933360; US2003187052; US2005107453 ChEBI
Warnings IRRITANT Matrix Scientific
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

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