| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 18 | Yes |
Popular Name: 2-(methylamino)-1-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]ethanone 2-(methylamino)-1-[4-(2-thienylm…
| 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) | 0.91 | 6.88 | -96.39 | 3 | 4 | 2 | 41 | 269.414 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.91 | 3.55 | -9.48 | 1 | 4 | 0 | 36 | 267.398 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.91 | 4.99 | -42.79 | 2 | 4 | 1 | 40 | 268.406 | 4 | ↓ |
