In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 5th, 2004 | 33 | No |
Popular Name: 3-[5-[(E)-[1-(4-carbethoxyphenyl)-3,5-diketo-pyrazolidin-4-ylidene]methyl]-2-furyl]benzoate 3-[5-[(E)-[1-(4-carbethoxyphenyl…
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) | 3.69 | 12.22 | -67.75 | 1 | 9 | -1 | 134 | 445.407 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.15 | 10.81 | -134.63 | 0 | 9 | -2 | 138 | 444.399 | 7 | ↓ |