In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2010 | 36 | No |
Popular Name: (E)-dihydroxy-hydroxyimino-methoxy-methyl-(4-pyridylmethyl)BLAHdione (E)-dihydroxy-hydroxyimino-metho…
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) | 3.32 | 4.27 | -16.46 | 3 | 9 | 0 | 133 | 485.496 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.32 | 4.73 | -48.08 | 4 | 9 | 1 | 134 | 486.504 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.