In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2005 | 33 | Yes |
Popular Name: CCCSc1nc(c2c(n1)n(nn2)[C@H]3[C@@H]([C@@H]([C@H](C34CC4)O)O)O)N[C@@H]5C[C@H]5c6ccccc6 CCCSc1nc(c2c(n1)n(nn2)[C@H]3[C@@…
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) | 2.15 | -8.75 | -13.26 | 4 | 9 | 0 | 129 | 468.583 | 7 | ↓ |