In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2011 | 18 | Yes |
Popular Name: (2R,5R)-N-cyclooctyl-5-methyl-piperazine-2-carboxamide (2R,5R)-N-cyclooctyl-5-methyl-pi…
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 | 2.13 | -43.63 | 4 | 4 | 1 | 58 | 254.398 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.08 | 0.86 | -6.64 | 3 | 4 | 0 | 53 | 253.39 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.