| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2010 | 24 | Yes |
Popular Name: 8-chloro-1-isopropyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine 8-chloro-1-isopropyl-6-phenyl-4H…
| 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) | 3.35 | 10.07 | -11.29 | 0 | 4 | 0 | 43 | 336.826 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.35 | 10.92 | -33.95 | 1 | 4 | 1 | 45 | 337.834 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US3987052; US4000289; US5334592 | IBM Patent Data |
