In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 29 | Yes |
Popular Name: (4-ethylpiperazin-1-yl)-[4-[(4-phenylpiperazin-1-yl)methyl]phenyl]methanone (4-ethylpiperazin-1-yl)-[4-[(4-p…
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) | 2.56 | 10.49 | -44.82 | 1 | 5 | 1 | 31 | 393.555 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 12.7 | -98.07 | 2 | 5 | 2 | 32 | 394.563 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 8.28 | -9.6 | 0 | 5 | 0 | 30 | 392.547 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 10.5 | -51.49 | 1 | 5 | 1 | 31 | 393.555 | 5 | ↓ |