In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 17 | Yes |
Popular Name: (2S)-1-(1-piperidyl)-N-[[(2R)-tetrahydropyran-2-yl]methyl]propan-2-amine (2S)-1-(1-piperidyl)-N-[[(2R)-te…
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) | 2.25 | 7.43 | -108.54 | 3 | 3 | 2 | 30 | 242.407 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.25 | 6.22 | -29.72 | 2 | 3 | 1 | 26 | 241.399 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.25 | 5.66 | -31.8 | 2 | 3 | 1 | 29 | 241.399 | 5 | ↓ |