In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 17 | Yes |
Popular Name: [(1S,3S)-3-methyl-1-[[(2S)-tetrahydropyran-2-yl]methylamino]cyclohexyl]methanol [(1S,3S)-3-methyl-1-[[(2S)-tetra…
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) | 2.33 | 3.85 | -30.07 | 3 | 3 | 1 | 46 | 242.383 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.33 | 2.58 | -4 | 2 | 3 | 0 | 41 | 241.375 | 4 | ↓ |