In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2011 | 35 | No |
Popular Name: [4-[(E)-[(2E)-2-(2-chlorophenyl)imino-4-oxo-thiazolidin-5-ylidene]methyl]-2-methoxy-phenyl] [4-[(E)-[(2E)-2-(2-chlorophenyl)…
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) | 6.69 | 12.87 | -18.13 | 1 | 9 | 0 | 127 | 509.927 | 7 | ↓ |
Hi High (pH 8-9.5) | 7.14 | 11.57 | -48.72 | 0 | 9 | -1 | 130 | 508.919 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.