| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 17th, 2011 | 18 | No |
Popular Name: 6-(aminomethyl)-N-[[(3S)-1,1-dioxothiolan-3-yl]methyl]-2-methyl-pyrimidin-4-amine 6-(aminomethyl)-N-[[(3S)-1,1-dio…
| 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) | -0.38 | -0.34 | -60.61 | 4 | 6 | 1 | 100 | 271.366 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.38 | -0.74 | -17.7 | 3 | 6 | 0 | 98 | 270.358 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.38 | -0.35 | -42.54 | 4 | 6 | 1 | 99 | 271.366 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
