In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 19 | Yes |
Popular Name: (1S)-N,N-diethyl-1-[4-(trifluoromethylsulfanyl)phenyl]ethane-1,2-diamine (1S)-N,N-diethyl-1-[4-(trifluoro…
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) | 5.46 | 6.95 | -122.71 | 4 | 2 | 2 | 32 | 294.386 | 7 | ↓ |
Mid Mid (pH 6-8) | 5.46 | 5.07 | -49.07 | 3 | 2 | 1 | 31 | 293.378 | 7 | ↓ |