In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 13 | Yes |
Popular Name: 3-[(2-methylpyrimidin-4-yl)methylamino]propanenitrile 3-[(2-methylpyrimidin-4-yl)methy…
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) | -0.64 | 2.34 | -10.84 | 1 | 4 | 0 | 62 | 176.223 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.64 | 3.7 | -57.66 | 2 | 4 | 1 | 66 | 177.231 | 4 | ↓ |