| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 20 | Yes |
Popular Name: (1S)-1-(3,5-dimethylphenyl)-N-methyl-N-(2-pyridylmethyl)ethane-1,2-diamine (1S)-1-(3,5-dimethylphenyl)-N-me…
| 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) | 1.78 | 5.46 | -44.38 | 3 | 3 | 1 | 44 | 270.4 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.78 | 7.43 | -120.38 | 4 | 3 | 2 | 45 | 271.408 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.78 | 6.17 | -97.47 | 4 | 3 | 2 | 45 | 271.408 | 5 | ↓ |
