In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2008 | 33 | Yes |
Popular Name: N-[(2R)-2-dimethylamino-3-phenyl-propyl]-4-[(3,4-dimethylphenyl)sulfonylamino]benzamide N-[(2R)-2-dimethylamino-3-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) | 4.54 | 11.21 | -51.61 | 3 | 6 | 1 | 80 | 466.627 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.54 | 9.22 | -43.95 | 1 | 6 | -1 | 81 | 464.611 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.54 | 11.28 | -65.87 | 2 | 6 | 0 | 82 | 465.619 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.54 | 9.15 | -15.07 | 2 | 6 | 0 | 79 | 465.619 | 9 | ↓ |