In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2010 | 35 | Yes |
Popular Name: 2-isopentyl-3-methyl-1-(4-phenethylpiperazin-1-yl)pyrido[1,2-a]benzimidazole-4-carbonitrile 2-isopentyl-3-methyl-1-(4-phenet…
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) | 6.82 | 17.1 | -13.7 | 0 | 5 | 0 | 48 | 465.645 | 7 | ↓ |
Lo Low (pH 4.5-6) | 6.82 | 19.3 | -101.98 | 2 | 5 | 2 | 50 | 467.661 | 7 | ↓ |