In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2009 | 23 | Yes |
Popular Name: 4-[2-(4-methylpiperazin-1-yl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-yl]morpholine 4-[2-(4-methylpiperazin-1-yl)-5,…
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) | 0.92 | 8.27 | -89.98 | 3 | 7 | 2 | 63 | 320.441 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.92 | 4.56 | -6.75 | 1 | 7 | 0 | 57 | 318.425 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.92 | 5.93 | -48.11 | 2 | 7 | 1 | 61 | 319.433 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.92 | 6.91 | -38.95 | 2 | 7 | 1 | 58 | 319.433 | 2 | ↓ |