| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2009 | 22 | Yes |
Popular Name: 6-(4-methyl-1,4-diazepan-1-yl)-N4-phenyl-pyrimidine-2,4-diamine 6-(4-methyl-1,4-diazepan-1-yl)-N…
| 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) | 2.54 | 10.92 | -90.05 | 5 | 6 | 2 | 73 | 300.41 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.54 | 8.52 | -7.41 | 3 | 6 | 0 | 70 | 298.394 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 10.49 | -39.52 | 4 | 6 | 1 | 72 | 299.402 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 10.17 | -78.98 | 5 | 6 | 2 | 73 | 300.41 | 3 | ↓ |
