| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 30th, 2008 | 33 | Yes |
Popular Name: 4-(4-ethylpiperazin-1-yl)-N,2-diphenyl-7,8-dihydro-5H-pyrido[3,4-e]pyrimidine-6-carboxamide 4-(4-ethylpiperazin-1-yl)-N,2-di…
| 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) | 4.20 | 13.95 | -52.02 | 2 | 7 | 1 | 66 | 443.575 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.20 | 11.72 | -11.64 | 1 | 7 | 0 | 65 | 442.567 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.20 | 14.26 | -97.25 | 3 | 7 | 2 | 67 | 444.583 | 4 | ↓ |
