In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2011 | 29 | Yes |
Popular Name: 2-(diethylamino)-N-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methyl]acetamide 2-(diethylamino)-N-[[2-[(4-pheny…
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) | 3.44 | 10.45 | -37.25 | 2 | 5 | 1 | 40 | 395.571 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.44 | 8.58 | -7 | 1 | 5 | 0 | 39 | 394.563 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.44 | 13.02 | -105.24 | 3 | 5 | 2 | 41 | 396.579 | 9 | ↓ |