| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2009 | 16 | Yes |
Popular Name: (2S)-3,3,3-trifluoro-N2-methyl-N2-[(5-methylisoxazol-3-yl)methyl]propane-1,2-diamine (2S)-3,3,3-trifluoro-N2-methyl-N…
| 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) | 0.40 | 1.06 | -44.64 | 3 | 4 | 1 | 57 | 238.233 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.40 | 0.7 | -5.65 | 2 | 4 | 0 | 55 | 237.225 | 5 | ↓ |
