| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 21 | Yes |
Popular Name: 2-[4-(2,4-dimethylphenyl)sulfonyl-1,4-diazepan-1-yl]ethanamine 2-[4-(2,4-dimethylphenyl)sulfony…
| 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) | 1.04 | 2.69 | -50.62 | 3 | 5 | 1 | 68 | 312.459 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.04 | 4.5 | -126.04 | 4 | 5 | 2 | 69 | 313.467 | 4 | ↓ |
