In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 9th, 2009 | 20 | Yes |
Popular Name: 4-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-1H-pyrrole-2-carboxylic 4-[4-(2-hydroxyethyl)piperazin-1…
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) | -0.83 | -2.3 | -52.19 | 2 | 8 | -1 | 117 | 302.332 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.83 | 0 | -69.19 | 3 | 8 | 0 | 118 | 303.34 | 5 | ↓ |