UCSF

ZINC36103405

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 25 Yes

Popular Name: (3,5-dimethoxyphenyl)-[4-(morpholinomethyl)-1-piperidyl]methanone (3,5-dimethoxyphenyl)-[4-(morpho…

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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) 1.60 4.45 -11.26 0 6 0 51 348.443 5 ↓
Mid Mid (pH 6-8) 1.60 6.39 -48.93 1 6 1 52 349.451 5 ↓

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Rings

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

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