In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 14 | Yes |
Popular Name: (2R)-2-(5-chloro-2-thienyl)-2-pyrrolidin-1-yl-ethanamine (2R)-2-(5-chloro-2-thienyl)-2-py…
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) | 1.83 | 3.1 | -46.07 | 3 | 2 | 1 | 31 | 231.772 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.83 | 2.93 | -2 | 2 | 2 | 0 | 29 | 230.764 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.83 | 5.25 | -118.59 | 4 | 2 | 2 | 32 | 232.78 | 3 | ↓ |