In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2010 | 26 | Yes |
Popular Name: (2R)-2-(4-ethoxyphenyl)-2-[4-(morpholine-4-carbonyl)piperazin-1-yl]acetonitrile (2R)-2-(4-ethoxyphenyl)-2-[4-(mo…
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) | 1.78 | 5.55 | -12.52 | 0 | 7 | 0 | 69 | 358.442 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.78 | 7.44 | -54.78 | 1 | 7 | 1 | 70 | 359.45 | 4 | ↓ |