In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 20 | Yes |
Popular Name: N-[(2S)-2-phenyl-2-pyrrolidin-1-yl-ethyl]hexan-1-amine N-[(2S)-2-phenyl-2-pyrrolidin-1-…
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) | 4.21 | 11.69 | -124.9 | 3 | 2 | 2 | 21 | 276.468 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.21 | 9.43 | -39.4 | 2 | 2 | 1 | 20 | 275.46 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.21 | 10.76 | -30.06 | 2 | 2 | 1 | 16 | 275.46 | 9 | ↓ |