In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 19 | Yes |
Popular Name: 2-[4-(aminomethyl)phenoxy]-1-(4-methylpiperazin-1-yl)ethanone 2-[4-(aminomethyl)phenoxy]-1-(4-…
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) | 0.42 | 2.9 | -57.67 | 3 | 5 | 1 | 60 | 264.349 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.42 | 2.5 | -11.49 | 2 | 5 | 0 | 59 | 263.341 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.42 | 5.29 | -105.31 | 4 | 5 | 2 | 62 | 265.357 | 4 | ↓ |