| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 21 | Yes |
Popular Name: (2S)-N2-isopropyl-4-(4-methoxyphenyl)-2-methyl-N2-propyl-butane-1,2-diamine (2S)-N2-isopropyl-4-(4-methoxyph…
| 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) | 3.51 | 5.93 | -48.22 | 3 | 3 | 1 | 40 | 293.475 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.51 | 7.5 | -31.69 | 3 | 3 | 1 | 40 | 293.475 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.51 | 7.84 | -123.75 | 4 | 3 | 2 | 41 | 294.483 | 9 | ↓ |
