| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 18 | Yes |
Popular Name: (1S,2S)-N1-methyl-1-phenyl-N1-[(1S)-1,2,2-trimethylpropyl]propane-1,2-diamine (1S,2S)-N1-methyl-1-phenyl-N1-[(…
| 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) | 3.16 | 6.97 | -115.97 | 4 | 2 | 2 | 32 | 250.43 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.16 | 5.3 | -42.07 | 3 | 2 | 1 | 31 | 249.422 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.16 | 6.34 | -29.1 | 3 | 2 | 1 | 30 | 249.422 | 5 | ↓ |
