In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 17 | Yes |
Popular Name: (2-amino-5-fluoro-phenyl)-(1,4-diazepan-1-yl)methanone (2-amino-5-fluoro-phenyl)-(1,4-d…
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) | 0.05 | 3.47 | -44.52 | 4 | 4 | 1 | 63 | 238.286 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.05 | 2.1 | -6.86 | 3 | 4 | 0 | 58 | 237.278 | 1 | ↓ |