In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 25th, 2008 | 20 | Yes |
Popular Name: (1S,2R)-1-(5-bromo-2-methoxy-phenyl)-2-phenyl-butan-1-amine (1S,2R)-1-(5-bromo-2-methoxy-phe…
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) | 3.17 | 8.35 | -44.2 | 3 | 2 | 1 | 37 | 335.265 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.17 | 8.2 | -3.99 | 2 | 2 | 0 | 35 | 334.257 | 5 | ↓ |