In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2010 | 19 | No |
Popular Name: 2-[[2-[[(2R)-2-cyanopropyl]-ethyl-amino]-2-oxo-ethyl]-methyl-amino]-N-ethyl-acetamide 2-[[2-[[(2R)-2-cyanopropyl]-ethy…
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) | 0.58 | 5.21 | -54.47 | 2 | 6 | 1 | 78 | 269.369 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.58 | 3.01 | -20.95 | 1 | 6 | 0 | 76 | 268.361 | 8 | ↓ |