In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2009 | 19 | No |
Popular Name: 2-butenoic acid, 4-[(2-cyanoethyl)(phenylmethyl)amino]-4-oxo- 2-butenoic acid, 4-[(2-cyanoethy…
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) | 0.28 | 8.4 | -51.49 | 0 | 5 | -1 | 84 | 257.269 | 6 | ↓ |