In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2005 | 21 | Yes |
Popular Name: C[C@@H]1c2c3cc(c(cc3[nH]c2C[C@H]4[C@H]1CN(CC4)C)Cl)Cl C[C@@H]1c2c3cc(c(cc3[nH]c2C[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) | 5.03 | 0.29 | -42.39 | 2 | 2 | 1 | 20 | 324.275 | 0 | ↓ |