| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2010 | 33 | No |
Popular Name: N-[(2S)-2-(1-methylpyrrol-2-yl)-2-pyrrolidin-1-yl-ethyl]-N'-(oxoBLAHyl)oxamide N-[(2S)-2-(1-methylpyrrol-2-yl)-…
| 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) | 1.19 | 8.78 | -44.04 | 3 | 8 | 1 | 88 | 450.563 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.19 | 6.46 | -12.38 | 2 | 8 | 0 | 87 | 449.555 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![N-(ketoBLAHyl)-N'-[2-pyrrolidino-2-(1H-pyrrol-2-yl)ethyl]oxamide](http://zinc12.docking.org/img/rings/573629.gif)