| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 15 | Yes |
Popular Name: (2S,3R)-N3-(cyclohexylmethyl)-N2,N3-dimethyl-butane-2,3-diamine (2S,3R)-N3-(cyclohexylmethyl)-N2…
| 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) | 3.08 | 7.57 | -104.37 | 3 | 2 | 2 | 21 | 214.397 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.08 | 6.23 | -35.1 | 2 | 2 | 1 | 20 | 213.389 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.08 | 6.35 | -31.81 | 2 | 2 | 1 | 16 | 213.389 | 5 | ↓ |
