| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2008 | 21 | Yes |
Popular Name: N-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-1-(3-chlorophenyl)methanamine N-[(5-chloro-2,3-dihydro-1,4-ben…
| 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) | 3.86 | 8.45 | -53.15 | 2 | 3 | 1 | 35 | 325.215 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.86 | 7.09 | -7.14 | 1 | 3 | 0 | 30 | 324.207 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
