In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 17 | Yes |
Popular Name: (2R)-2-(4-ethylphenyl)-2-[(2-hydroxy-1,1-dimethyl-ethyl)amino]acetonitrile (2R)-2-(4-ethylphenyl)-2-[(2-hyd…
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) | 2.56 | 3.49 | -7.67 | 2 | 3 | 0 | 56 | 232.327 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 4.6 | -42.61 | 3 | 3 | 1 | 61 | 233.335 | 5 | ↓ |