| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2008 | 22 | Yes |
Popular Name: (2S)-N,N,2-trimethyl-4-(4-phenylphenoxy)butane-1,2-diamine (2S)-N,N,2-trimethyl-4-(4-phenyl…
| 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) | 3.33 | 6.99 | -45.35 | 3 | 3 | 1 | 40 | 299.438 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.33 | 8.05 | -35.99 | 3 | 3 | 1 | 40 | 299.438 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.33 | 8.87 | -122.97 | 4 | 3 | 2 | 41 | 300.446 | 7 | ↓ |
