In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 21 | Yes |
Popular Name: 1-(4-fluorophenyl)-4-(4-propylpiperazin-1-yl)butan-1-one 1-(4-fluorophenyl)-4-(4-propylpi…
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) | 2.97 | 8.77 | -38.04 | 1 | 3 | 1 | 25 | 293.406 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.97 | 6.5 | -7.52 | 0 | 3 | 0 | 24 | 292.398 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.97 | 8.77 | -42.67 | 1 | 3 | 1 | 25 | 293.406 | 7 | ↓ |