In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 16 | Yes |
Popular Name: 2-[(3-bromo-2-thienyl)methyl-(1-ethylpropyl)amino]ethanol 2-[(3-bromo-2-thienyl)methyl-(1-…
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) | 3.49 | 5.46 | -28.61 | 2 | 2 | 1 | 25 | 307.277 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.49 | 4.16 | -4.01 | 1 | 2 | 0 | 23 | 306.269 | 7 | ↓ |