In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2011 | 32 | No |
Popular Name: (2S)-N-(9,10-dioxo-1-anthryl)-2-methyl-3-oxo-4H-1,4-benzoxazine-6-sulfonamide (2S)-N-(9,10-dioxo-1-anthryl)-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) | 3.77 | 5.44 | -47.72 | 1 | 8 | -1 | 121 | 447.448 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.77 | 5.41 | -15.29 | 2 | 8 | 0 | 119 | 448.456 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.