| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 21 | Yes |
Popular Name: (1S,2S,4R)-N2-isopentyl-N1,N2-dimethyl-4-phenyl-cyclohexane-1,2-diamine (1S,2S,4R)-N2-isopentyl-N1,N2-di…
| 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) | 4.50 | 11.36 | -116.3 | 3 | 2 | 2 | 21 | 290.495 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.50 | 9.83 | -40.57 | 2 | 2 | 1 | 20 | 289.487 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.50 | 10.44 | -36.31 | 2 | 2 | 1 | 16 | 289.487 | 6 | ↓ |
