In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2010 | 19 | Yes |
Popular Name: N-(2-cyanoethyl)-N-methyl-3-[methyl-[2-oxo-2-(propylamino)ethyl]amino]propanamide N-(2-cyanoethyl)-N-methyl-3-[met…
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 | 5.19 | -49.47 | 2 | 6 | 1 | 78 | 269.369 | 9 | ↓ |
Hi High (pH 8-9.5) | -0.09 | 2.92 | -15.3 | 1 | 6 | 0 | 76 | 268.361 | 9 | ↓ |