In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 19 | Yes |
Popular Name: (2R)-1-(2-methoxy-5-methyl-phenyl)-2-piperazin-1-yl-propan-1-one (2R)-1-(2-methoxy-5-methyl-pheny…
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) | 1.55 | 5.29 | -44.62 | 2 | 4 | 1 | 46 | 263.361 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.55 | 3.87 | -9.81 | 1 | 4 | 0 | 42 | 262.353 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.55 | 6.08 | -33.57 | 2 | 4 | 1 | 43 | 263.361 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.55 | 7.48 | -115.78 | 3 | 4 | 2 | 47 | 264.369 | 4 | ↓ |