In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2011 | 21 | Yes |
Popular Name: (2S)-N-(3-fluoro-4-hydroxy-phenyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide (2S)-N-(3-fluoro-4-hydroxy-pheny…
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) | 2.33 | 2.71 | -18.08 | 3 | 5 | 0 | 71 | 288.278 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.33 | 3.47 | -57.45 | 2 | 5 | -1 | 73 | 287.27 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.