In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 14 | Yes |
Popular Name: (2R)-2-(2-cyanoethyl-methyl-amino)-N-isopropyl-propanamide (2R)-2-(2-cyanoethyl-methyl-amin…
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) | -0.09 | 4.39 | -47.73 | 2 | 4 | 1 | 57 | 198.29 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.09 | 2.09 | -10.18 | 1 | 4 | 0 | 56 | 197.282 | 5 | ↓ |