In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2009 | 30 | Yes |
Popular Name: [6-[4-[[5-(4-bromophenyl)-2-thienyl]methyl]piperazin-1-yl]-6-oxo-hexyl]urea [6-[4-[[5-(4-bromophenyl)-2-thie…
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) | 4.19 | 7.1 | -18.51 | 3 | 6 | 0 | 79 | 493.471 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.19 | 9.37 | -58.88 | 4 | 6 | 1 | 80 | 494.479 | 9 | ↓ |