In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 19 | Yes |
Popular Name: 1-methyl-4-(4-methylpiperazin-1-yl)sulfonyl-pyrrole-2-carboxylic 1-methyl-4-(4-methylpiperazin-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) | -0.14 | 3.45 | -76.89 | 1 | 7 | 0 | 87 | 287.341 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.14 | 1.07 | -53.13 | 0 | 7 | -1 | 86 | 286.333 | 3 | ↓ |