In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2011 | 15 | No |
Popular Name: (3-hydroxyazetidin-1-yl)-(4-nitro-1H-pyrrol-2-yl)methanone (3-hydroxyazetidin-1-yl)-(4-nitr…
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) | -0.37 | -0.01 | -39.97 | 1 | 7 | -1 | 100 | 210.169 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.37 | 0.3 | -19.33 | 2 | 7 | 0 | 102 | 211.177 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.