In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2008 | 21 | Yes |
Popular Name: (1S,2S)-1-(p-tolyl)-2-[(1S,5R)-3,3,5-trimethylcyclohexoxy]propan-1-amine (1S,2S)-1-(p-tolyl)-2-[(1S,5R)-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) | 2.79 | 9.6 | -44.49 | 3 | 2 | 1 | 37 | 290.471 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.79 | 9.26 | -1.49 | 2 | 2 | 0 | 35 | 289.463 | 4 | ↓ |