In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2005 | 29 | Yes |
Popular Name: CS(=O)(=O)n1cc(c2c1cccc2)C[C@@H](C(=O)O)NC(=O)c3c(cccc3Cl)Cl CS(=O)(=O)n1cc(c2c1cccc2)C[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) | 1.56 | -3.78 | -65.76 | 1 | 7 | -1 | 108 | 454.311 | 6 | ↓ |