In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 24 | Yes |
Popular Name: 5-[[4-[(5-carboxy-2-furyl)methyl]piperazin-1-yl]methyl]furan-2-carboxylic 5-[[4-[(5-carboxy-2-furyl)methyl…
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) | 1.17 | 5.42 | -106.29 | 1 | 8 | -1 | 114 | 333.32 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.17 | 3.03 | -106.81 | 0 | 8 | -2 | 113 | 332.312 | 6 | ↓ |