UCSF

ZINC67935464

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2011 24 Yes

Popular Name: (4-fluoro-3-methyl-phenyl)-[4-[(1R)-1-morpholinoethyl]-1-piperidyl]methanone (4-fluoro-3-methyl-phenyl)-[4-[(…

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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) 2.42 6.97 -8.67 0 4 0 33 334.435 3 ↓
Mid Mid (pH 6-8) 2.42 8.74 -44.78 1 4 1 34 335.443 3 ↓

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

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