UCSF

ZINC12336503

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 14th, 2008 15 Yes

Popular Name: [1-(3-fluorobenzyl)-1H-1,2,3-triazol-4-yl]methanol [1-(3-fluorobenzyl)-1H-1,2,3-tri…

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CAS Numbers: 952183-23-2 , N/A

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) 1.16 2.28 -10.33 1 4 0 51 207.208 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 64 - 66 KeyOrganics
MP 64-66° Matrix Scientific
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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