| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 20 | Yes |
Popular Name: 2-methyl-N-[(2S)-3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyrimidin-4-amine 2-methyl-N-[(2S)-3-methyl-2-(4-m…
| 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) | 1.11 | 5.54 | -38.75 | 2 | 5 | 1 | 45 | 278.424 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.11 | 3.16 | -5.57 | 1 | 5 | 0 | 44 | 277.416 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.11 | 6.69 | -80.95 | 3 | 5 | 2 | 47 | 279.432 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
