In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 15 | Yes |
Popular Name: (3S)-3-[(2-methylpyrimidin-4-yl)amino]piperidin-2-one (3S)-3-[(2-methylpyrimidin-4-yl)…
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) | -0.42 | 1.57 | -11.93 | 2 | 5 | 0 | 67 | 206.249 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.42 | 2.01 | -31.81 | 3 | 5 | 1 | 68 | 207.257 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.