In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 20 | Yes |
Popular Name: (2R)-N-[4-(1-cyano-1-methyl-ethyl)phenyl]morpholine-2-carboxamide (2R)-N-[4-(1-cyano-1-methyl-ethy…
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) | 1.32 | 4.99 | -56.62 | 3 | 5 | 1 | 79 | 274.344 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.32 | 3.64 | -13.49 | 2 | 5 | 0 | 74 | 273.336 | 3 | ↓ |