In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 29th, 2007 | 33 | No |
Popular Name: 2-(2-nitro-5-piperazin-1-yl-phenyl)-4-(p-tolyl)phthalazin-1-one 2-(2-nitro-5-piperazin-1-yl-phen…
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) | 4.35 | 12.45 | -66.55 | 2 | 8 | 1 | 101 | 442.499 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.35 | 11.16 | -20.62 | 1 | 8 | 0 | 96 | 441.491 | 4 | ↓ |