In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 2nd, 2011 | 23 | Yes |
Popular Name: N-(2-ethyl-3-methyl-4-quinolyl)-2-(1-piperidyl)acetamide N-(2-ethyl-3-methyl-4-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) | 3.86 | 8.06 | -34.65 | 2 | 4 | 1 | 50 | 312.437 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.05 | 7.23 | -12.04 | 1 | 4 | 0 | 45 | 311.429 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.86 | 8.56 | -36.3 | 1 | 4 | 0 | 53 | 311.429 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.86 | 8.99 | -86.77 | 3 | 4 | 2 | 51 | 313.445 | 3 | ↓ |