| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 20 | No |
Popular Name: 5-chloro-1-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]pentan-1-one 5-chloro-1-[4-(2-thienylmethyl)-…
| 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) | 2.78 | 10.48 | -42.81 | 1 | 3 | 1 | 25 | 315.89 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.78 | 8.61 | -9.51 | 0 | 3 | 0 | 24 | 314.882 | 6 | ↓ |
