| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2005 | 30 | No |
Popular Name: c1ccc2c(c1)C[C@H](c3ccccc3N2C(=O)N)OC(=O)c4ccc(cc4)[N+](=O)[O-] c1ccc2c(c1)C[C@H](c3ccccc3N2C(=O…
| 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) | 4.67 | 0.97 | -12.79 | 2 | 8 | 0 | 118 | 403.394 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0751129A1; EP0751129B1; US5753646 | IBM Patent Data |
