In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2005 | 24 | Yes |
Popular Name: 7-benzyl-2-(4-ethylpiperazin-1-yl)-3,5,7,8,9-pentazabicyclo[4.3.0]nona-2,4,8,10-tetraene 7-benzyl-2-(4-ethylpiperazin-1-y…
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) | 1.84 | 10.34 | -40.74 | 1 | 7 | 1 | 64 | 324.412 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.84 | 8.12 | -7.1 | 0 | 7 | 0 | 63 | 323.404 | 4 | ↓ |