| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 22nd, 2015 | 19 | Yes |
Popular Name: Methyl 4-(5-methoxy-2-nitrophenyl)-3-oxobutanoate Methyl 4-(5-methoxy-2-nitropheny…
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CAS Number: 130916-41-5
| 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) | 1.05 | 7.43 | -17.79 | 0 | 7 | 0 | 98 | 267.237 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.