In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2004 | 31 | Yes |
Popular Name: 2-[(3-cyano-6-ethoxy-2-quinolyl)thio]-N-[2-(1H-indol-3-yl)ethyl]acetamide 2-[(3-cyano-6-ethoxy-2-quinolyl)…
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) | 4.03 | 9.72 | -17.94 | 2 | 6 | 0 | 91 | 430.533 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.03 | 9.97 | -49.81 | 3 | 6 | 1 | 92 | 431.541 | 8 | ↓ |