UCSF

ZINC19735898

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2008 18 Yes

Popular Name: 1-[3-Chloro-5-(trifluoromethyl)pyridin-2-yl]-piperidine-4-ol 1-[3-Chloro-5-(trifluoromethyl)p…

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CAS Number: 306976-40-9

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) 1.67 3.46 -5.12 1 3 0 36 280.677 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 81 - 83 KeyOrganics
Warnings IRRITANT Matrix Scientific

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