In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 15th, 2011 | 14 | Yes |
Popular Name: (2S,6S)-1-(1H-imidazol-4-ylmethyl)-2,6-dimethyl-piperazine (2S,6S)-1-(1H-imidazol-4-ylmethy…
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) | -0.08 | 2.62 | -85.08 | 4 | 4 | 2 | 50 | 196.298 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.08 | 2.44 | -38.77 | 3 | 4 | 1 | 49 | 195.29 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.