In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 19 | Yes |
Popular Name: 1-[(5-chloro-2,3-dimethoxy-phenyl)methyl]-4-methyl-piperazine 1-[(5-chloro-2,3-dimethoxy-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) | 2.08 | 5.86 | -35.26 | 1 | 4 | 1 | 26 | 285.795 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.08 | 5.72 | -35.49 | 1 | 4 | 1 | 26 | 285.795 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.08 | 3.39 | -4.39 | 0 | 4 | 0 | 25 | 284.787 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.