| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 17 | Yes |
Popular Name: (1R,2S)-N1-methyl-N1-[[(2S)-tetrahydropyran-2-yl]methyl]cycloheptane-1,2-diamine (1R,2S)-N1-methyl-N1-[[(2S)-tetr…
| 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) | 1.99 | 4.16 | -37.75 | 3 | 3 | 1 | 40 | 241.399 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.99 | 5.78 | -31.45 | 3 | 3 | 1 | 40 | 241.399 | 3 | ↓ |
