| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 18th, 2011 | 27 | Yes |
Popular Name: (4,5-dimethyl-2-pyrrol-1-yl-3-thienyl)-[4-(4-pyridylmethyl)piperazin-1-yl]methanone (4,5-dimethyl-2-pyrrol-1-yl-3-th…
| 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) | 1.90 | 9.25 | -12.6 | 0 | 5 | 0 | 41 | 380.517 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.90 | 11.46 | -50.19 | 1 | 5 | 1 | 43 | 381.525 | 4 | ↓ |
![[4-(4-pyridylmethyl)piperazino]-(2-pyrrol-1-yl-3-thienyl)methanone](http://zinc12.docking.org/img/rings/171485.gif)
