In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 16 | No |
Popular Name: 2-chloro-N-(2-cyanoethyl)-N-(3-pyridylmethyl)acetamide 2-chloro-N-(2-cyanoethyl)-N-(3-p…
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) | -0.11 | 5.75 | -16.95 | 0 | 4 | 0 | 57 | 237.69 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.11 | 6.2 | -45.48 | 1 | 4 | 1 | 58 | 238.698 | 5 | ↓ |