| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 19 | Yes |
Popular Name: (1S,2S,4R)-N1,N2,4-trimethyl-N2-(m-tolylmethyl)cyclohexane-1,2-diamine (1S,2S,4R)-N1,N2,4-trimethyl-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) | 3.34 | 9.44 | -115.02 | 3 | 2 | 2 | 21 | 262.441 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.34 | 8.2 | -33.8 | 2 | 2 | 1 | 16 | 261.433 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.34 | 7.52 | -35.3 | 2 | 2 | 1 | 20 | 261.433 | 4 | ↓ |
