In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 33 | Yes |
Popular Name: N-[3-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-4-methoxy-phenyl]-4-(p-tolyl)benzenesulfonamide N-[3-[(3R,5S)-3,5-dimethylpipera…
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) | 5.34 | 9.55 | -42.55 | 3 | 6 | 1 | 75 | 466.627 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.34 | 9.69 | -63.33 | 2 | 6 | 0 | 77 | 465.619 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.34 | 8.38 | -10.1 | 2 | 6 | 0 | 71 | 465.619 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.34 | 8.51 | -48 | 1 | 6 | -1 | 73 | 464.611 | 6 | ↓ |