| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 19 | Yes |
Popular Name: (2S)-N2,2-dimethyl-N2-[(1S)-1-methylbutyl]-4-phenyl-butane-1,2-diamine (2S)-N2,2-dimethyl-N2-[(1S)-1-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) | 3.67 | 6.68 | -43.2 | 3 | 2 | 1 | 31 | 263.449 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.67 | 8.08 | -31.16 | 3 | 2 | 1 | 30 | 263.449 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.67 | 8.4 | -121.74 | 4 | 2 | 2 | 32 | 264.457 | 8 | ↓ |
