In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: (1S)-1-(4-isobutylphenyl)-N,N'-dimethyl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine (1S)-1-(4-isobutylphenyl)-N,N'-d…
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) | 3.94 | 8.54 | -37.49 | 2 | 2 | 1 | 20 | 303.392 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.94 | 6.37 | -3.25 | 1 | 2 | 0 | 15 | 302.384 | 8 | ↓ |