In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 18 | Yes |
Popular Name: 2-(aminomethyl)-5-bromo-N-propyl-N-(2,2,2-trifluoroethyl)aniline 2-(aminomethyl)-5-bromo-N-propyl…
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 | 6.91 | -55.1 | 3 | 2 | 1 | 31 | 326.18 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.77 | 6.51 | -4.04 | 2 | 2 | 0 | 29 | 325.172 | 6 | ↓ |