| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2011 | 16 | Yes |
Popular Name: (1S,2R)-N2-(cyclobutylmethyl)-N1,N2-dimethyl-cycloheptane-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) | 3.06 | 7.47 | -28.84 | 2 | 2 | 1 | 16 | 225.4 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.06 | 8.34 | -111.84 | 3 | 2 | 2 | 21 | 226.408 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
