In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 27 | No |
Popular Name: 2-[4-[2-phenyl-3-(p-tolyl)-1,2,4-thiadiazol-2-ium-5-yl]piperazin-1-yl]ethanol 2-[4-[2-phenyl-3-(p-tolyl)-1,2,4…
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) | 0.41 | 8.33 | -21.7 | 1 | 5 | 1 | 43 | 381.525 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.41 | 10.61 | -82.08 | 2 | 5 | 2 | 45 | 382.533 | 5 | ↓ |