In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 21 | Yes |
Popular Name: (1R)-N-ethyl-1-[3-fluoro-4-(4-isopropylpiperazin-1-yl)phenyl]ethanamine (1R)-N-ethyl-1-[3-fluoro-4-(4-is…
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) | 3.19 | 9.77 | -78.8 | 3 | 3 | 2 | 24 | 295.446 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.19 | 7.4 | -41.03 | 2 | 3 | 1 | 23 | 294.438 | 5 | ↓ |