| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2007 | 19 | Yes |
Popular Name: 8-ethyl-9-methyl-3,4-dihydro-1H-pyrido[3',2':4,5]thieno[3,2-e][1,4]diazepine-2,5-dione 8-ethyl-9-methyl-3,4-dihydro-1H-…
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CAS Number: 879577-16-9
| 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) | 2.16 | 1.9 | -12.44 | 2 | 5 | 0 | 71 | 275.333 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 2.16 | 2.24 | -36.88 | 3 | 5 | 1 | 72 | 276.341 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.98 | -0.4 | -32.57 | 3 | 5 | 1 | 76 | 276.341 | 1 | ↓ |
