| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 9th, 2004 | 30 | No |
Popular Name: 4-methylbenzoic-acid-[(2E)-3-keto-2-(3-nitrobenzylidene)coumaran-6-yl]-ester 4-methylbenzoic-acid-[(2E)-3-ket…
| 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) | 5.46 | 4.43 | -11.39 | 0 | 7 | 0 | 102 | 401.374 | 5 | ↓ |
