| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 20 | No |
Popular Name: (2S)-2-bromo-3-methyl-1-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]butan-1-one (2S)-2-bromo-3-methyl-1-[4-(2-th…
| 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) | 2.97 | 9.81 | -46 | 1 | 3 | 1 | 25 | 360.341 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.97 | 7.91 | -9.34 | 0 | 3 | 0 | 24 | 359.333 | 4 | ↓ |
