In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 17th, 2011 | 28 | No |
Popular Name: 2-[benzyl-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]amino]acetic 2-[benzyl-[(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) | -0.87 | 6.03 | -49.14 | 2 | 10 | -1 | 155 | 383.34 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.04 | 3.82 | -89.56 | 1 | 10 | -2 | 158 | 382.332 | 7 | ↓ |
Mid Mid (pH 6-8) | -0.87 | 8.68 | -47.98 | 3 | 10 | 0 | 156 | 384.348 | 7 | ↓ |