| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 17th, 2010 | 20 | Yes |
Popular Name: (1R)-N-butyl-1-(2-methoxyphenyl)-N-[(1S)-1-methylpropyl]ethane-1,2-diamine (1R)-N-butyl-1-(2-methoxyphenyl)…
| 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) | 3.38 | 7.24 | -111.33 | 4 | 3 | 2 | 41 | 280.456 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.38 | 5.34 | -39.67 | 3 | 3 | 1 | 40 | 279.448 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.38 | 7 | -26.21 | 3 | 3 | 1 | 40 | 279.448 | 9 | ↓ |
