In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 26th, 2009 | 16 | Yes |
Popular Name: (2R)-2-(5-methyl-2-furyl)-2-(4-methyl-1-piperidyl)acetonitrile (2R)-2-(5-methyl-2-furyl)-2-(4-m…
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) | 2.34 | 5.84 | -6.88 | 0 | 3 | 0 | 40 | 218.3 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.34 | 8.12 | -37.65 | 1 | 3 | 1 | 41 | 219.308 | 2 | ↓ |