In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 31 | Yes |
Popular Name: 6-benzyl-4-[4-(p-tolylmethyl)piperazin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine 6-benzyl-4-[4-(p-tolylmethyl)pip…
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) | 3.61 | 16.19 | -106.02 | 2 | 5 | 2 | 38 | 415.585 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.61 | 11.69 | -6.11 | 0 | 5 | 0 | 35 | 413.569 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.61 | 13.99 | -44.53 | 1 | 5 | 1 | 37 | 414.577 | 5 | ↓ |