| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 14th, 2011 | 18 | Yes |
Popular Name: 6-(aminomethyl)-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2-methyl-pyrimidin-4-amine 6-(aminomethyl)-N-[[(2S)-1-ethyl…
| 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) | 0.52 | 4.4 | -94.38 | 5 | 5 | 2 | 70 | 251.378 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.52 | 1.84 | -5.59 | 3 | 5 | 0 | 67 | 249.362 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.52 | 4 | -36.03 | 4 | 5 | 1 | 68 | 250.37 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.52 | 4.39 | -79.1 | 5 | 5 | 2 | 70 | 251.378 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
