In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 19 | Yes |
Popular Name: 1-(5-fluoro-2-hydroxy-phenyl)-2-(4-methyl-1,4-diazepan-1-yl)ethanone 1-(5-fluoro-2-hydroxy-phenyl)-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) | 1.73 | 5.58 | -36.29 | 2 | 4 | 1 | 45 | 267.324 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.73 | 6.58 | -58.93 | 1 | 4 | 0 | 48 | 266.316 | 3 | ↓ |