In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 1st, 2009 | 26 | Yes |
Popular Name: (2-hydroxy-4-methoxy-phenyl)-[4-[(5-methyl-2-thienyl)sulfonyl]piperazin-1-yl]methanone (2-hydroxy-4-methoxy-phenyl)-[4-…
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) | 2.40 | 2.69 | -18.72 | 1 | 7 | 0 | 87 | 396.49 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.40 | 3.51 | -58.5 | 0 | 7 | -1 | 90 | 395.482 | 4 | ↓ |