In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2010 | 25 | Yes |
Popular Name: 1-benzyl-4-(2-bromo-5-chloro-4-methyl-phenyl)sulfonyl-piperazine 1-benzyl-4-(2-bromo-5-chloro-4-m…
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) | 4.33 | 7.05 | -7.62 | 0 | 4 | 0 | 41 | 443.794 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.33 | 9.26 | -44.66 | 1 | 4 | 1 | 42 | 444.802 | 4 | ↓ |