In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 24 | Yes |
Popular Name: 2-(2-diethylaminoethylamino)-1-[4-(2-fluorophenyl)piperazin-1-yl]ethanone 2-(2-diethylaminoethylamino)-1-[…
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) | 1.59 | 6.67 | -40.8 | 2 | 5 | 1 | 40 | 337.463 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.59 | 4.45 | -8.53 | 1 | 5 | 0 | 39 | 336.455 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.59 | 5.82 | -46.08 | 2 | 5 | 1 | 43 | 337.463 | 8 | ↓ |