In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 19th, 2008 | 28 | No |
Popular Name: (1R,2S)-1,2-bis(5-nitro-1H-benzimidazol-2-yl)ethane-1,2-diol (1R,2S)-1,2-bis(5-nitro-1H-benzi…
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) | 1.00 | 2.2 | -16.15 | 4 | 12 | 0 | 189 | 384.308 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.00 | 1.19 | -33.28 | 3 | 12 | -1 | 188 | 383.3 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.00 | 1.79 | -32.55 | 3 | 12 | -1 | 188 | 383.3 | 5 | ↓ |