In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 18 | Yes |
Popular Name: 1-(1,4-diazepan-1-ylsulfonyl)-4-methyl-1,4-diazepane 1-(1,4-diazepan-1-ylsulfonyl)-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) | -0.55 | 2.76 | -110.14 | 3 | 6 | 2 | 62 | 278.422 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.55 | 0.36 | -47.87 | 2 | 6 | 1 | 60 | 277.414 | 2 | ↓ |