In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2009 | 21 | Yes |
Popular Name: (1S,2S)-N-methyl-N-phenethyl-2-pyrrolidin-1-yl-cyclohexanamine (1S,2S)-N-methyl-N-phenethyl-2-p…
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) | 3.97 | 12.17 | -110.11 | 2 | 2 | 2 | 9 | 288.479 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.97 | 11.57 | -31.05 | 1 | 2 | 1 | 8 | 287.471 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.97 | 10.05 | -33.44 | 1 | 2 | 1 | 8 | 287.471 | 5 | ↓ |