In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 13 | Yes |
Popular Name: N-[(5-bromo-2-thienyl)methyl]-2,2,2-trifluoro-ethanamine N-[(5-bromo-2-thienyl)methyl]-2,…
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) | 3.25 | 4.14 | -4.93 | 1 | 1 | 0 | 12 | 274.105 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.25 | 5.55 | -48.95 | 2 | 1 | 1 | 17 | 275.113 | 4 | ↓ |