In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 17th, 2011 | 22 | No |
Popular Name: 2-[methyl-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]amino]acetic 2-[methyl-[(7-nitro-2,3-dioxo-1,…
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) | -2.27 | 5.17 | -50.76 | 3 | 10 | 0 | 156 | 308.25 | 5 | ↓ |
Hi High (pH 8-9.5) | -1.36 | 0.67 | -97.74 | 1 | 10 | -2 | 158 | 306.234 | 5 | ↓ |
Mid Mid (pH 6-8) | -2.27 | 2.86 | -50.27 | 2 | 10 | -1 | 155 | 307.242 | 5 | ↓ |
Mid Mid (pH 6-8) | -1.36 | 2.98 | -75.68 | 2 | 10 | -1 | 159 | 307.242 | 5 | ↓ |