In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 29 | Yes |
Popular Name: 2-[(4-benzylpiperazin-1-yl)methyl]-N-[[(2S)-1,4-dioxan-2-yl]methyl]oxazole-4-carboxamide 2-[(4-benzylpiperazin-1-yl)methy…
None
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) | 0.62 | 2.96 | -47.09 | 2 | 8 | 1 | 81 | 401.487 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.62 | 2.97 | -45.92 | 2 | 8 | 1 | 81 | 401.487 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.62 | 0.65 | -10.02 | 1 | 8 | 0 | 80 | 400.479 | 7 | ↓ |