In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 5th, 2011 | 19 | Yes |
Popular Name: (2S)-1-[(3S,5R)-3,5-dimethyl-1-piperidyl]-3-(4-methyl-1-piperidyl)propan-2-ol (2S)-1-[(3S,5R)-3,5-dimethyl-1-p…
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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) | 2.50 | 8.02 | -101.3 | 3 | 3 | 2 | 29 | 270.461 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.50 | 5.72 | -34.4 | 2 | 3 | 1 | 28 | 269.453 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.50 | 5.8 | -33.94 | 2 | 3 | 1 | 28 | 269.453 | 4 | ↓ |