In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 20 | Yes |
Popular Name: (1R)-1-(3-bromophenyl)-2-[[(1R,3R)-1-(hydroxymethyl)-3-methyl-cyclohexyl]amino]ethanol (1R)-1-(3-bromophenyl)-2-[[(1R,3…
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) | 3.05 | 3.99 | -36.86 | 4 | 3 | 1 | 57 | 343.285 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.05 | 3.21 | -4.01 | 3 | 3 | 0 | 52 | 342.277 | 5 | ↓ |