| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 26th, 2004 | 27 | Yes |
Popular Name: 3-methyl-7-(3-methylbenzyl)-8-(4-methylpiperidino)xanthine 3-methyl-7-(3-methylbenzyl)-8-(4…
| 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) | 2.64 | -2.31 | -8.08 | 1 | 7 | 0 | 75 | 367.453 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.64 | -2.06 | -36.13 | 2 | 7 | 1 | 77 | 368.461 | 3 | ↓ |
