In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 19 | Yes |
Popular Name: (2S)-1-(diethylamino)-3-[[(1S,3S)-1-(hydroxymethyl)-3-methyl-cyclohexyl]amino]propan-2-ol (2S)-1-(diethylamino)-3-[[(1S,3S…
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) | 1.58 | 2.96 | -97.05 | 5 | 4 | 2 | 61 | 274.449 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.58 | 0.81 | -33.74 | 4 | 4 | 1 | 60 | 273.441 | 8 | ↓ |