| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 13th, 2010 | 22 | Yes |
Popular Name: N4-methyl-6-(4-methylpiperazin-1-yl)-N4-phenyl-pyrimidine-2,4-diamine N4-methyl-6-(4-methylpiperazin-1…
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| 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) | 2.08 | 10.12 | -82.72 | 4 | 6 | 2 | 64 | 300.41 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.08 | 8.05 | -7.94 | 2 | 6 | 0 | 62 | 298.394 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.08 | 7.75 | -24.93 | 3 | 6 | 1 | 63 | 299.402 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.08 | 8.43 | -26.6 | 3 | 6 | 1 | 63 | 299.402 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.08 | 10.42 | -42.77 | 3 | 6 | 1 | 63 | 299.402 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.08 | 10.79 | -91.36 | 4 | 6 | 2 | 64 | 300.41 | 3 | ↓ |
