| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2011 | 19 | No |
Popular Name: 1-(2-chloroethyl)-4-[(6-methoxy-2-pyridyl)methyl]-1,4-diazepane 1-(2-chloroethyl)-4-[(6-methoxy-…
| 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) | 1.74 | 4.87 | -37.43 | 1 | 4 | 1 | 30 | 284.811 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.74 | 2.86 | -5.34 | 0 | 4 | 0 | 29 | 283.803 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
