In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2010 | 23 | Yes |
Popular Name: [6-oxo-6-[4-(2-thienylmethyl)piperazin-1-yl]hexyl]urea [6-oxo-6-[4-(2-thienylmethyl)pip…
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) | 1.47 | 2.73 | -15.66 | 3 | 6 | 0 | 79 | 338.477 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.47 | 4.93 | -52.4 | 4 | 6 | 1 | 80 | 339.485 | 8 | ↓ |