In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 17 | No |
Popular Name: N-[[4-(difluoromethoxy)-3-nitro-phenyl]methyl]ethanamine N-[[4-(difluoromethoxy)-3-nitro-…
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) | 2.37 | 6.32 | -53.4 | 2 | 5 | 1 | 72 | 247.221 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.37 | 4.95 | -8.93 | 1 | 5 | 0 | 67 | 246.213 | 6 | ↓ |