In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2005 | 31 | No |
Popular Name: Cn1c(nnn1)SCC2=C(N3[C@@H]([C@H](C3=O)NC(=O)[C@H](c4ccccc4)O)SC2)C(=O)O Cn1c(nnn1)SCC2=C(N3[C@@H]([C@H](…
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) | -0.47 | -3.75 | -61.29 | 2 | 11 | -1 | 153 | 461.505 | 7 | ↓ |