UCSF

ZINC20365911

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2008 26 Yes

Popular Name: N-(3-chlorobenzyl)-2,2-bis(4-fluorophenyl)-2-hydroxy-1-ethanaminium chloride N-(3-chlorobenzyl)-2,2-bis(4-flu…

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CAS Number: 317822-05-2

Other Names:

MFCD00231463

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) 4.47 8.61 -9.57 2 2 0 32 373.83 6 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 196 - 199 KeyOrganics

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