In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 18 | Yes |
Popular Name: (1R,2R,4R)-N2-isobutyl-N2-(2-methoxyethyl)-N1,4-dimethyl-cyclohexane-1,2-diamine (1R,2R,4R)-N2-isobutyl-N2-(2-met…
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) | 2.63 | 6.14 | -32.65 | 2 | 3 | 1 | 29 | 257.442 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.63 | 7.37 | -25.85 | 2 | 3 | 1 | 26 | 257.442 | 7 | ↓ |