| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 19 | Yes |
Popular Name: N-[[2-(aminomethyl)phenyl]methyl]-N-isobutyl-N',N'-dimethyl-ethane-1,2-diamine N-[[2-(aminomethyl)phenyl]methyl…
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|
| Hi High (pH 8-9.5) | 2.03 | 8.13 | -107.32 | 4 | 3 | 2 | 35 | 265.445 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.03 | 6.89 | -36.28 | 3 | 3 | 1 | 34 | 264.437 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.03 | 5.65 | -29.85 | 3 | 3 | 1 | 34 | 264.437 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.03 | 6.03 | -112.12 | 4 | 3 | 2 | 35 | 265.445 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.03 | 7.28 | -109.62 | 4 | 3 | 2 | 35 | 265.445 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.03 | 8.49 | -223.95 | 5 | 3 | 3 | 37 | 266.453 | 8 | ↓ |
