In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 14th, 2008 | 18 | Yes |
Popular Name: 1-ethyl-3-(2-methylprop-2-enoxy)-6,7-dihydro-5H-cyclopenta[d]pyridine-4-carbonitrile 1-ethyl-3-(2-methylprop-2-enoxy)…
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) | 3.35 | 1.91 | -7.56 | 0 | 3 | 0 | 46 | 242.322 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.35 | 2.47 | -34.64 | 1 | 3 | 1 | 47 | 243.33 | 4 | ↓ |