In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: 4-[4-(3-thienylmethyl)piperazin-1-yl]sulfonylbutanoic 4-[4-(3-thienylmethyl)piperazin-…
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) | 0.38 | 3.81 | -51.9 | 0 | 6 | -1 | 81 | 331.439 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.38 | 6.03 | -79.19 | 1 | 6 | 0 | 82 | 332.447 | 7 | ↓ |