| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 29 | No |
None
None
| 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) | 4.18 | 11.39 | -44.93 | 2 | 5 | 1 | 68 | 390.459 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.18 | 9.84 | -47.91 | 0 | 5 | -1 | 70 | 388.443 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.18 | 9.07 | -10.74 | 1 | 5 | 0 | 67 | 389.451 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.18 | 12.16 | -31.16 | 1 | 5 | 0 | 71 | 389.451 | 5 | ↓ |
![7-[(benzylamino)methyl]-2-(2-furfurylidene)coumaran-3-one](http://zinc12.docking.org/img/rings/538354.gif)
