In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2005 | 31 | No |
Popular Name: C[C@@]1(C(=O)N(C(=O)N1)CCCN2CCC(CC2)(C#N)c3ccccc3)c4ccccc4 C[C@@]1(C(=O)N(C(=O)N1)CCCN2CCC(…
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) | 3.36 | 1.26 | -49.45 | 2 | 6 | 1 | 77 | 417.533 | 6 | ↓ |