In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 17 | Yes |
Popular Name: 1-(2-chloro-4-fluoro-phenyl)-N-[[(2S)-1,4-dioxan-2-yl]methyl]methanamine 1-(2-chloro-4-fluoro-phenyl)-N-[…
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) | 1.90 | 5.11 | -41.4 | 2 | 3 | 1 | 35 | 260.716 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.90 | 3.72 | -4.71 | 1 | 3 | 0 | 30 | 259.708 | 4 | ↓ |