In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2005 | 33 | Yes |
Popular Name: C[S@@](=O)c1cccnc1CNC(=O)Cn2c(cnc(c2=O)NCC(c3ccccn3)(F)F)Cl C[S@@](=O)c1cccnc1CNC(=O)Cn2c(cn…
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) | 0.11 | -3.83 | -27.15 | 2 | 9 | 0 | 118 | 496.927 | 9 | ↓ |