In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2010 | 20 | Yes |
Popular Name: (1S)-N-ethyl-2-[(1S,3S)-3-methylcyclohexoxy]-1-(o-tolyl)ethanamine (1S)-N-ethyl-2-[(1S,3S)-3-methyl…
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) | 4.35 | 9.76 | -33.52 | 2 | 2 | 1 | 26 | 276.444 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.35 | 8.92 | -1.65 | 1 | 2 | 0 | 21 | 275.436 | 6 | ↓ |