In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2009 | 17 | Yes |
Popular Name: 1-[2-[2-cyanoethyl(methyl)amino]-2-oxo-ethyl]cyclopentanecarboxylic 1-[2-[2-cyanoethyl(methyl)amino]…
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) | 0.12 | 7.63 | -59.2 | 0 | 5 | -1 | 84 | 237.279 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.12 | 5.15 | -18.85 | 1 | 5 | 0 | 81 | 238.287 | 5 | ↓ |