| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2008 | 18 | Yes |
Popular Name: (2S)-N,N-dimethyl-4-(2,3,6-trimethylphenoxy)butane-1,2-diamine (2S)-N,N-dimethyl-4-(2,3,6-trime…
| 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) | 2.29 | 5.06 | -43.11 | 3 | 3 | 1 | 40 | 251.394 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.29 | 6.91 | -32.47 | 3 | 3 | 1 | 40 | 251.394 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.29 | 7.07 | -125.91 | 4 | 3 | 2 | 41 | 252.402 | 6 | ↓ |
