In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2011 | 29 | No |
Popular Name: 4-acetyl-N-(4-chloro-2-nitro-phenyl)-2,2-dimethyl-3H-1,4-benzoxazine-6-sulfonamide 4-acetyl-N-(4-chloro-2-nitro-phe…
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) | 3.39 | 7.11 | -55.83 | 0 | 9 | -1 | 124 | 438.869 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.39 | 7.03 | -19.9 | 1 | 9 | 0 | 122 | 439.877 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.