| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 20 | Yes |
Popular Name: 2-(cyclopropylamino)-1-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]ethanone 2-(cyclopropylamino)-1-[4-(2-thi…
| 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) | 1.27 | 8.47 | -95.61 | 3 | 4 | 2 | 41 | 295.452 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.27 | 5.31 | -9.65 | 1 | 4 | 0 | 36 | 293.436 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.27 | 6.6 | -40.55 | 2 | 4 | 1 | 40 | 294.444 | 5 | ↓ |
