In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 18 | No |
Popular Name: 2-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]acetonitrile 2-[4-[(5-chloro-2-thienyl)sulfon…
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) | 1.68 | 2.12 | -12.57 | 0 | 5 | 0 | 64 | 305.812 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.68 | 4.41 | -58.7 | 1 | 5 | 1 | 66 | 306.82 | 3 | ↓ |