UCSF

ZINC54945735

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 9th, 2010 28 No

Popular Name: N'-[3-(dimethylaminomethyl)phenyl]-N-[2-[(3R,5R)-3,5-dimethyl-1-piperidyl]-2-methyl-propyl]oxamide N'-[3-(dimethylaminomethyl)pheny…

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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) 2.47 9.25 -79.08 4 6 2 67 390.572 7 ↓
Hi High (pH 8-9.5) 2.47 6.78 -34.71 3 6 1 66 389.564 7 ↓

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

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