| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 21 | Yes |
Popular Name: (1R,2S)-N'-isobutyl-N'-methyl-1,2-diphenyl-ethane-1,2-diamine (1R,2S)-N'-isobutyl-N'-methyl-1,…
| 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) | 2.16 | 9.6 | -112.47 | 4 | 2 | 2 | 32 | 284.447 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.16 | 7.67 | -41.17 | 3 | 2 | 1 | 31 | 283.439 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.16 | 8.11 | -1.51 | 2 | 2 | 0 | 29 | 282.431 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.16 | 9.22 | -30.3 | 3 | 2 | 1 | 30 | 283.439 | 6 | ↓ |
