In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 32 | Yes |
Popular Name: N-[(2S)-2-dimethylamino-2-phenyl-ethyl]-2-methyl-5-(m-tolylsulfamoyl)benzamide N-[(2S)-2-dimethylamino-2-phenyl…
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) | 4.31 | 9.84 | -44.42 | 3 | 6 | 1 | 80 | 452.6 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.38 | 5.67 | -49.25 | 1 | 6 | -1 | 84 | 450.584 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.31 | 7.77 | -45.31 | 1 | 6 | -1 | 81 | 450.584 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.38 | 8.41 | -76.19 | 2 | 6 | 0 | 85 | 451.592 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.31 | 7.76 | -10.26 | 2 | 6 | 0 | 79 | 451.592 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.31 | 9.84 | -65.75 | 2 | 6 | 0 | 82 | 451.592 | 8 | ↓ |