| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2005 | 33 | Yes |
Popular Name: c1ccc(cc1)[C@H]2C[C@H]3C=C(CCN3C2)c4c[nH]c(c4c5ccncc5)c6ccc(cc6)F c1ccc(cc1)[C@H]2C[C@H]3C=C(CCN3C…
| 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) | 5.63 | 2.11 | -43.14 | 2 | 3 | 1 | 33 | 436.554 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 5.63 | 2.22 | -94.63 | 3 | 3 | 2 | 34 | 437.562 | 4 | ↓ |
