| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 21 | Yes |
Popular Name: 1-isopropyl-4-(4-methylpiperazin-1-yl)sulfonyl-pyrrole-2-carboxylic 1-isopropyl-4-(4-methylpiperazin…
| 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) | 0.60 | 3.26 | -52.86 | 0 | 7 | -1 | 86 | 314.387 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.60 | 5.62 | -74.3 | 1 | 7 | 0 | 87 | 315.395 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
