| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 21 | Yes |
Popular Name: (1S)-N'-methyl-1-(4-propylphenyl)-N'-(4-pyridylmethyl)ethane-1,2-diamine (1S)-N'-methyl-1-(4-propylphenyl…
| 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) | 0.87 | 7 | -47.58 | 3 | 3 | 1 | 44 | 284.427 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.87 | 6.58 | -4.06 | 2 | 3 | 0 | 42 | 283.419 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.87 | 7.46 | -97.99 | 4 | 3 | 2 | 45 | 285.435 | 7 | ↓ |
