In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 11th, 2011 | 17 | Yes |
Popular Name: (3S)-N-ethyl-1-(4-methoxy-2-methyl-phenyl)pyrrolidin-3-amine (3S)-N-ethyl-1-(4-methoxy-2-meth…
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) | 2.75 | 6.79 | -40.59 | 2 | 3 | 1 | 29 | 235.351 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.75 | 5.62 | -3.29 | 1 | 3 | 0 | 24 | 234.343 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.75 | 5.59 | -30.84 | 2 | 3 | 1 | 26 | 235.351 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.75 | 6.77 | -109.64 | 3 | 3 | 2 | 30 | 236.359 | 4 | ↓ |