In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 2009 | 18 | Yes |
Popular Name: 3-[(2S)-2-methyl-1-piperidyl]-N-[[(2S)-tetrahydropyran-2-yl]methyl]propan-1-amine 3-[(2S)-2-methyl-1-piperidyl]-N-…
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) | 2.17 | 7.83 | -100.22 | 3 | 3 | 2 | 30 | 256.434 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.17 | 6.42 | -31.03 | 2 | 3 | 1 | 26 | 255.426 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.17 | 5.73 | -37.19 | 2 | 3 | 1 | 29 | 255.426 | 6 | ↓ |