In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 33 | Yes |
Popular Name: 4-[1-(p-tolylsulfonyl)indol-3-yl]-N-[2-(3-pyridyl)ethyl]butanamide 4-[1-(p-tolylsulfonyl)indol-3-yl…
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) | 4.15 | 10.7 | -21.5 | 1 | 6 | 0 | 81 | 461.587 | 9 | ↓ |
Lo Low (pH 4.5-6) | 4.15 | 11.17 | -49.52 | 2 | 6 | 1 | 82 | 462.595 | 9 | ↓ |