In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 18 | Yes |
Popular Name: (1R)-1-(3,4-dimethylphenyl)-2-[(2R)-2-methylmorpholin-4-yl]ethanamine (1R)-1-(3,4-dimethylphenyl)-2-[(…
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) | 0.49 | 4.33 | -43.62 | 3 | 3 | 1 | 40 | 249.378 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.49 | 3.57 | -3.31 | 2 | 3 | 0 | 38 | 248.37 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.49 | 6.26 | -131.91 | 4 | 3 | 2 | 41 | 250.386 | 3 | ↓ |