| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 17 | Yes |
Popular Name: (1S)-N-(cyclopropylmethyl)-N-propyl-1-(2-pyridyl)ethane-1,2-diamine (1S)-N-(cyclopropylmethyl)-N-pro…
| 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) | 1.31 | 6.6 | -26.54 | 3 | 3 | 1 | 43 | 234.367 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.31 | 4.52 | -3.31 | 2 | 3 | 0 | 42 | 233.359 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.31 | 6.95 | -116.05 | 4 | 3 | 2 | 45 | 235.375 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.31 | 5.14 | -43.13 | 3 | 3 | 1 | 44 | 234.367 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.31 | 3.88 | -102.61 | 4 | 3 | 2 | 45 | 235.375 | 7 | ↓ |
