| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 13 | Yes |
Popular Name: 3-(prop-2-yn-1-ylamino)benzoic acid 3-(prop-2-yn-1-ylamino)benzoic acid
Find On: PubMed — Wikipedia — Google
CAS Number: 923112-68-9
| 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) | 1.84 | 4.2 | -53.66 | 1 | 3 | -1 | 52 | 174.179 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_PATENT_ID | US4440940 | IBM Patent Data |
