In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 28th, 2006 | 25 | Yes |
Popular Name: 4-(4-benzylpiperazin-1-yl)carbonyl-9-thia-2,6-diazabicyclo[4.3.0]nona-1,3,7-trien-5-one 4-(4-benzylpiperazin-1-yl)carbon…
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) | 0.81 | -0.24 | -50.72 | 1 | 6 | 1 | 59 | 355.443 | 3 | ↓ |