In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2008 | 26 | Yes |
Popular Name: 2-(4-ethylpiperazin-1-yl)-4-methyl-N-(2-morpholinoethyl)pyrimidine-5-carboxamide 2-(4-ethylpiperazin-1-yl)-4-meth…
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) | 0.51 | 4.14 | -45.99 | 2 | 8 | 1 | 75 | 363.486 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.51 | 1.76 | -11.05 | 1 | 8 | 0 | 74 | 362.478 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.51 | 6.49 | -93.97 | 3 | 8 | 2 | 76 | 364.494 | 6 | ↓ |