| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2009 | 27 | Yes |
Popular Name: (1S)-2-(m-tolylsulfonyl)-1-(4-pyridylmethyl)-3,4-dihydro-1H-isoquinoline (1S)-2-(m-tolylsulfonyl)-1-(4-py…
| 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) | 3.77 | 9.48 | -11.37 | 0 | 4 | 0 | 50 | 378.497 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.77 | 9.92 | -44.86 | 1 | 4 | 1 | 52 | 379.505 | 4 | ↓ |
