In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 21 | Yes |
Popular Name: (1S,2R)-N2-ethyl-1-(4-ethylphenyl)-N1-methyl-N2-(2,2,2-trifluoroethyl)propane-1,2-diamine (1S,2R)-N2-ethyl-1-(4-ethylpheny…
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) | 4.26 | 5.49 | -2.35 | 1 | 2 | 0 | 15 | 302.384 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.26 | 9.25 | -113.08 | 3 | 2 | 2 | 21 | 304.4 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.26 | 7.43 | -32.64 | 2 | 2 | 1 | 16 | 303.392 | 8 | ↓ |