In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 18 | Yes |
Popular Name: (2S)-N-(3-chloro-4-cyano-phenyl)morpholine-2-carboxamide (2S)-N-(3-chloro-4-cyano-phenyl)…
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) | 0.75 | 3.87 | -64.58 | 3 | 5 | 1 | 79 | 266.708 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.75 | 2.52 | -15.22 | 2 | 5 | 0 | 74 | 265.7 | 2 | ↓ |