In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2009 | 26 | Yes |
Popular Name: (1R)-2-(m-tolylsulfonyl)-1-(4-pyridyl)-3,4-dihydro-1H-isoquinoline (1R)-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) | 3.56 | 8.92 | -11.65 | 0 | 4 | 0 | 50 | 364.47 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.56 | 9.36 | -39.99 | 1 | 4 | 1 | 52 | 365.478 | 3 | ↓ |