| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 16th, 2008 | 19 | Yes |
Popular Name: 1-[(4-tert-butylphenyl)methyl]-4-methyl-1,4-diazepane 1-[(4-tert-butylphenyl)methyl]-4…
| 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) | 3.61 | 9.18 | -32.89 | 1 | 2 | 1 | 8 | 261.433 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.61 | 11.14 | -107.87 | 2 | 2 | 2 | 9 | 262.441 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.61 | 9.13 | -32.83 | 1 | 2 | 1 | 8 | 261.433 | 3 | ↓ |
