In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 20 | Yes |
Popular Name: (2R)-1-[(1R,3S)-3-methylcyclohexoxy]-3-[[(2S)-tetrahydropyran-2-yl]methylamino]propan-2-ol (2R)-1-[(1R,3S)-3-methylcyclohex…
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) | 1.88 | 4.47 | -39.65 | 3 | 4 | 1 | 55 | 286.436 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.88 | 3.05 | -5.42 | 2 | 4 | 0 | 51 | 285.428 | 7 | ↓ |