In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 20 | Yes |
Popular Name: (4S)-N4-[[1-(difluoromethyl)imidazol-2-yl]methyl]-N1,N1-diethyl-pentane-1,4-diamine (4S)-N4-[[1-(difluoromethyl)imid…
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) | 1.87 | 8.49 | -93.31 | 3 | 4 | 2 | 39 | 290.402 | 10 | ↓ |
Hi High (pH 8-9.5) | 1.87 | 7.34 | -34.63 | 2 | 4 | 1 | 34 | 289.394 | 10 | ↓ |