In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 21 | Yes |
Popular Name: (1R)-1-(4-methoxyphenyl)-2-[(1S,5R)-3,3,5-trimethylcyclohexoxy]ethanamine (1R)-1-(4-methoxyphenyl)-2-[(1S,…
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) | 2.03 | 7.39 | -45.18 | 3 | 3 | 1 | 46 | 292.443 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.03 | 6.99 | -3.31 | 2 | 3 | 0 | 44 | 291.435 | 5 | ↓ |