In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 18 | Yes |
Popular Name: (1S)-2-[(5-bromo-2-thienyl)methylamino]-1-(2-chlorophenyl)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) | 3.77 | 4.9 | -4.84 | 2 | 2 | 0 | 32 | 346.677 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.77 | 6.24 | -44.03 | 3 | 2 | 1 | 37 | 347.685 | 5 | ↓ |