UCSF

ZINC08733633

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2007 35 No

Popular Name: 2-(4-fluorophenoxy)-4-methoxy-N-[({2-[3-(trifluoromethyl)phenoxy]ethoxy}imino)methyl]nicotinamide 2-(4-fluorophenoxy)-4-methoxy-N-…

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CAS Number: 341966-88-9

Other Names:

MFCD00975424

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) 4.45 9.38 -19.91 1 8 0 91 493.413 11 ↓
Mid Mid (pH 6-8) 4.45 10.05 -49.14 2 8 1 93 494.421 11 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 122 - 124 KeyOrganics

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