| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2011 | 17 | Yes |
Popular Name: (1S,2R)-N2-(cyclobutylmethyl)-N1,N2-dimethyl-cyclooctane-1,2-diamine (1S,2R)-N2-(cyclobutylmethyl)-N1…
| 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) | 3.57 | 7.72 | -29.05 | 2 | 2 | 1 | 16 | 239.427 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.57 | 8.69 | -113.35 | 3 | 2 | 2 | 21 | 240.435 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
