In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: (1S,2R,4R)-4-ethyl-N2-[(4-methoxyphenyl)methyl]-N1,N2-dimethyl-cyclohexane-1,2-diamine (1S,2R,4R)-4-ethyl-N2-[(4-methox…
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) | 3.66 | 9.42 | -117.74 | 3 | 3 | 2 | 30 | 292.467 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.66 | 8.52 | -38.3 | 2 | 3 | 1 | 26 | 291.459 | 6 | ↓ |