In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 20 | Yes |
Popular Name: (2R)-2-(3,4-dimethylphenyl)-3-[(3S,5S)-3,5-dimethyl-1-piperidyl]propan-1-amine (2R)-2-(3,4-dimethylphenyl)-3-[(…
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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) | 3.66 | 9.3 | -110.72 | 4 | 2 | 2 | 32 | 276.468 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.66 | 8.92 | -31.1 | 3 | 2 | 1 | 30 | 275.46 | 4 | ↓ |