In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 20 | Yes |
Popular Name: 4-(4-isopropylpiperazin-1-yl)sulfonyl-1H-pyrrole-2-carboxylic 4-(4-isopropylpiperazin-1-yl)sul…
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) | 0.47 | 3.76 | -68.57 | 2 | 7 | 0 | 98 | 301.368 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.47 | 1.6 | -50.46 | 1 | 7 | -1 | 97 | 300.36 | 4 | ↓ |