In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 19 | Yes |
Popular Name: (1S)-2-[(5-bromo-2-thienyl)methylamino]-1-(4-methoxyphenyl)ethanol (1S)-2-[(5-bromo-2-thienyl)methy…
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) | 3.20 | 3.73 | -5.75 | 2 | 3 | 0 | 41 | 342.258 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.20 | 5.06 | -50.06 | 3 | 3 | 1 | 46 | 343.266 | 6 | ↓ |