In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2009 | 18 | Yes |
Popular Name: N-[[1-(difluoromethyl)imidazol-2-yl]methyl]-1-[(2S)-1-ethylpyrrolidin-2-yl]methanamine N-[[1-(difluoromethyl)imidazol-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) | 1.01 | 5.73 | -31.87 | 2 | 4 | 1 | 34 | 259.324 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.01 | 3.95 | -6.27 | 1 | 4 | 0 | 33 | 258.316 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.01 | 7.06 | -108.44 | 3 | 4 | 2 | 39 | 260.332 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.01 | 6.07 | -84.76 | 3 | 4 | 2 | 36 | 260.332 | 6 | ↓ |