In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 21 | Yes |
Popular Name: 1-[5-(2,3-dimethylphenoxy)pentyl]-4-methyl-piperazine 1-[5-(2,3-dimethylphenoxy)pentyl…
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) | 3.76 | 9.01 | -36.6 | 1 | 3 | 1 | 17 | 291.459 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.76 | 6.75 | -4.45 | 0 | 3 | 0 | 16 | 290.451 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.76 | 9.13 | -35.01 | 1 | 3 | 1 | 17 | 291.459 | 7 | ↓ |