In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 17th, 2011 | 24 | No |
Popular Name: 3,3-dimethyl-N-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]butanamide 3,3-dimethyl-N-[(7-nitro-2,3-dio…
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) | 0.45 | 3.96 | -14.83 | 3 | 9 | 0 | 141 | 334.332 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.36 | 1.79 | -42.42 | 2 | 9 | -1 | 144 | 333.324 | 5 | ↓ |