| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 17 | Yes |
Popular Name: (3R,4S)-N3-cycloheptyl-N3,N4-dimethyl-tetrahydropyran-3,4-diamine (3R,4S)-N3-cycloheptyl-N3,N4-dim…
| 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) | 2.63 | 5.78 | -114.08 | 3 | 3 | 2 | 30 | 242.407 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.63 | 2.26 | -1.52 | 1 | 3 | 0 | 24 | 240.391 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.63 | 4.55 | -29.83 | 2 | 3 | 1 | 26 | 241.399 | 3 | ↓ |
