| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2008 | 31 | Yes |
Popular Name: N-tert-butyl-2-[4-[2-oxo-2-[(4-phenylphenyl)amino]ethyl]-1,4-diazepan-1-yl]acetamide N-tert-butyl-2-[4-[2-oxo-2-[(4-p…
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| 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) | 4.26 | 9.18 | -52.16 | 3 | 6 | 1 | 66 | 423.581 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.26 | 9.16 | -46.37 | 3 | 6 | 1 | 66 | 423.581 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.26 | 7.19 | -18.66 | 2 | 6 | 0 | 65 | 422.573 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.26 | 11.26 | -122.63 | 4 | 6 | 2 | 67 | 424.589 | 7 | ↓ |
