In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 16th, 2010 | 16 | Yes |
Popular Name: (3S)-N-ethyl-1-[[(3R)-1-methyl-3-piperidyl]methyl]pyrrolidin-3-amine (3S)-N-ethyl-1-[[(3R)-1-methyl-3…
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) | 1.43 | 5.46 | -80.07 | 3 | 3 | 2 | 24 | 227.396 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.43 | 4.26 | -32.7 | 2 | 3 | 1 | 20 | 226.388 | 4 | ↓ |