In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2009 | 18 | Yes |
Popular Name: (2R)-2-[[(2R)-2-(2-thienyl)pyrrolidin-1-yl]methyl]pentanedinitrile (2R)-2-[[(2R)-2-(2-thienyl)pyrro…
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) | 2.11 | 6.96 | -11.07 | 0 | 3 | 0 | 51 | 259.378 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.11 | 9.3 | -49.1 | 1 | 3 | 1 | 52 | 260.386 | 5 | ↓ |