| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 14 | Yes |
Popular Name: Benzoic acid, 3-amino-4-methyl-, propyl ester (9CI) Benzoic acid, 3-amino-4-methyl-,…
Find On: PubMed — Wikipedia — Google
CAS Number: 76765-55-4
| 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) | 2.85 | 5.5 | -6.19 | 2 | 3 | 0 | 52 | 193.246 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4070353 | IBM Patent Data |
