| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2010 | 34 | No |
Popular Name: N-[[1-[(1-methylpyrrol-2-yl)methyl]-4-piperidyl]methyl]-N'-(oxoBLAHyl)oxamide N-[[1-[(1-methylpyrrol-2-yl)meth…
| 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) | 1.37 | 10.22 | -49.5 | 3 | 8 | 1 | 88 | 464.59 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.37 | 7.99 | -13.13 | 2 | 8 | 0 | 87 | 463.582 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![N-(ketoBLAHyl)-N'-[[1-(1H-pyrrol-2-ylmethyl)-4-piperidyl]methyl]oxamide](http://zinc12.docking.org/img/rings/577006.gif)