In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 21 | Yes |
Popular Name: (2S)-N-[(2R)-2-phenyl-2-pyrrolidin-1-yl-ethyl]heptan-2-amine (2S)-N-[(2R)-2-phenyl-2-pyrrolid…
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) | 4.89 | 12.03 | -114.36 | 3 | 2 | 2 | 21 | 290.495 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.89 | 9.96 | -36.52 | 2 | 2 | 1 | 20 | 289.487 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.89 | 10.82 | -33.8 | 2 | 2 | 1 | 16 | 289.487 | 9 | ↓ |