| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2005 | 29 | Yes |
Popular Name: Cc1c(c(c([nH]1)c2ccc(cc2)F)c3ccncc3)C4=C[C@H]5C[C@@H](CN5CC4)C Cc1c(c(c([nH]1)c2ccc(cc2)F)c3ccn…
| 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) | 5.43 | 1.87 | -37.08 | 2 | 3 | 1 | 33 | 388.51 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 5.43 | 1.98 | -90.81 | 3 | 3 | 2 | 34 | 389.518 | 3 | ↓ |
