UCSF

ZINC55576037

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 16th, 2010 29 Yes

Popular Name: N-[(2,6-difluorophenyl)methyl]-N-[[1-[(2-fluorophenyl)methyl]-4-piperidyl]methyl]-2-methoxy-ethanami N-[(2,6-difluorophenyl)methyl]-N…

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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) 4.27 11.72 -32.89 1 3 1 17 407.5 9 ↓
Mid Mid (pH 6-8) 4.27 9.44 -6.06 0 3 0 16 406.492 9 ↓

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

No pre-computed analogs available. Try a structural similarity search.