In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: (1S,2R,4R)-N2,4-diethyl-N2-[[(2S)-tetrahydrofuran-2-yl]methyl]cyclohexane-1,2-diamine (1S,2R,4R)-N2,4-diethyl-N2-[[(2S…
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) | 2.05 | 4.58 | -37.37 | 3 | 3 | 1 | 40 | 255.426 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.05 | 6.43 | -28.87 | 3 | 3 | 1 | 40 | 255.426 | 5 | ↓ |