| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 12 | No |
Popular Name: DNC013972 DNC013972
| 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) | 1.86 | 3.55 | -6.79 | 1 | 2 | 0 | 37 | 184.622 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4347176; US4347177; US4347178; US4347382; US4355179 | IBM Patent Data |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| GABT-2-E | Gamma-amino-N-butyrate Transaminase (cluster #2 Of 3), Eukaryotic | Eukaryotes | 3990 | 0.63 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| GABT_RAT | P50554 | Gamma-amino-N-butyrate Transaminase, Rat | 3990 | 0.63 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Degradation of GABA |
