In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2005 | 30 | No |
Popular Name: C[C@@H]1CN(CCN1C(=O)C(=O)c2c[nH]c3c2c(ccc3F)F)C(=O)c4ccccn4 C[C@@H]1CN(CCN1C(=O)C(=O)c2c[nH]…
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) | 1.28 | 0.13 | -13.99 | 1 | 7 | 0 | 86 | 412.396 | 3 | ↓ |