| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 19th, 2011 | 46 | No |
Popular Name: BRD-K42120899-001-01-3 BRD-K42120899-001-01-3
| 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) | 6.28 | 14.76 | -68.73 | 4 | 9 | 1 | 105 | 627.737 | 10 | ↓ |
| Hi High (pH 8-9.5) | 6.28 | 12.41 | -22.12 | 3 | 9 | 0 | 103 | 626.729 | 10 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1-[6-keto-2-[[(4-phenoxybenzyl)amino]methyl]-2,3,4,5-tetrahydro-1,5-benzoxazocin-8-yl]-3-phenyl-urea](http://zinc12.docking.org/img/rings/476893.gif)