| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2010 | 20 | Yes |
Popular Name: (2S)-3-methyl-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]butan-2-amine (2S)-3-methyl-N-[2-(4-pyrimidin-…
| 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) | 1.88 | 7.33 | -41.48 | 2 | 5 | 1 | 49 | 278.424 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.88 | 9.53 | -119.35 | 3 | 5 | 2 | 50 | 279.432 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
