In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 20th, 2010 | 21 | Yes |
Popular Name: 1-[(2-chlorophenyl)methylsulfonyl]-4-isobutyl-piperazine 1-[(2-chlorophenyl)methylsulfony…
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) | 2.96 | 5.63 | -9.45 | 0 | 4 | 0 | 41 | 330.881 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.96 | 7.57 | -47.64 | 1 | 4 | 1 | 42 | 331.889 | 5 | ↓ |