| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2009 | 29 | Yes |
Popular Name: (1S)-1-(4-pyridylmethyl)-2-(2,4,6-trimethylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline (1S)-1-(4-pyridylmethyl)-2-(2,4,…
| 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 | 11.3 | -11.52 | 0 | 4 | 0 | 50 | 406.551 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.54 | 11.74 | -37.82 | 1 | 4 | 1 | 52 | 407.559 | 4 | ↓ |
