In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 16 | Yes |
Popular Name: N,N-dimethyl-2-[(2R)-2-(3-pyridyl)pyrrolidin-1-yl]ethanamine N,N-dimethyl-2-[(2R)-2-(3-pyridy…
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) | 1.12 | 5.93 | -37.26 | 1 | 3 | 1 | 21 | 220.34 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.12 | 5.26 | -34.08 | 1 | 3 | 1 | 21 | 220.34 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.12 | 3.46 | -4.11 | 0 | 3 | 0 | 19 | 219.332 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.12 | 7.73 | -108.04 | 2 | 3 | 2 | 22 | 221.348 | 4 | ↓ |