In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 16 | No |
Popular Name: 2-[(3-chlorophenyl)methylamino]-N-(cyanomethyl)acetamide 2-[(3-chlorophenyl)methylamino]-…
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) | 1.54 | 2.69 | -10.71 | 2 | 4 | 0 | 65 | 237.69 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.54 | 4.04 | -54.95 | 3 | 4 | 1 | 69 | 238.698 | 5 | ↓ |