In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2009 | 18 | Yes |
Popular Name: 2-[4-(3,6-dimethylpyrazin-2-yl)-1,4-diazepan-1-yl]ethanamine 2-[4-(3,6-dimethylpyrazin-2-yl)-…
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) | -0.13 | 3.09 | -45.87 | 3 | 5 | 1 | 60 | 250.37 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.13 | 4.88 | -119.47 | 4 | 5 | 2 | 61 | 251.378 | 3 | ↓ |