In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 21 | Yes |
Popular Name: (1R)-N-[(1R)-1-(5-bromo-2-thienyl)ethyl]-1-(2,4-dimethoxyphenyl)ethanamine (1R)-N-[(1R)-1-(5-bromo-2-thieny…
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) | 4.89 | 7.97 | -39.32 | 2 | 3 | 1 | 35 | 371.32 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.89 | 7.1 | -4.67 | 1 | 3 | 0 | 30 | 370.312 | 6 | ↓ |