In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2008 | 25 | Yes |
Popular Name: (2S)-N-[(2S)-2-dimethylamino-2-(4-ethylphenyl)ethyl]-2,3-dihydrobenzothiophene-2-carboxamide (2S)-N-[(2S)-2-dimethylamino-2-(…
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) | 3.98 | 11.56 | -45.37 | 2 | 3 | 1 | 34 | 355.527 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.98 | 9.46 | -10.22 | 1 | 3 | 0 | 32 | 354.519 | 6 | ↓ |