In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 20 | Yes |
Popular Name: 5-bromo-2-(ethylaminomethyl)-N-isopropyl-N-(2,2,2-trifluoroethyl)aniline 5-bromo-2-(ethylaminomethyl)-N-i…
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) | 4.31 | 9.19 | -47.31 | 2 | 2 | 1 | 20 | 354.234 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.31 | 8.56 | -3.03 | 1 | 2 | 0 | 15 | 353.226 | 7 | ↓ |