| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2011 | 20 | Yes |
Popular Name: (1R)-1-(7-bromo-1,3-benzodioxol-5-yl)-N-(cyclobutylmethyl)-N-methyl-ethane-1,2-diamine (1R)-1-(7-bromo-1,3-benzodioxol-…
| 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) | 2.40 | 4.64 | -55.03 | 3 | 4 | 1 | 49 | 342.257 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.40 | 6.33 | -131.22 | 4 | 4 | 2 | 51 | 343.265 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
