In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 25 | Yes |
Popular Name: 2-[5-(4-benzylpiperazin-1-yl)sulfonyl-2-thienyl]acetic 2-[5-(4-benzylpiperazin-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) | 2.15 | 6.18 | -47.7 | 0 | 6 | -1 | 81 | 379.483 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.15 | 8.4 | -74.45 | 1 | 6 | 0 | 82 | 380.491 | 6 | ↓ |