In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | Yes |
Popular Name: 3-(aminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroquinolin-2-amine 3-(aminomethyl)-N-methyl-N-(2,2,…
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) | 2.60 | 6.63 | -106.34 | 4 | 3 | 2 | 45 | 275.318 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.60 | 5.92 | -7.12 | 2 | 3 | 0 | 42 | 273.302 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.60 | 6.27 | -55.34 | 3 | 3 | 1 | 44 | 274.31 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.60 | 6.23 | -24.48 | 3 | 3 | 1 | 43 | 274.31 | 4 | ↓ |