In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2005 | 28 | Yes |
Popular Name: C[C@@H]1c2c3cc(ccc3[nH]c2C[C@H]4[C@H]1CN(CC4)CCCN(C)C)C(F)(F)F C[C@@H]1c2c3cc(ccc3[nH]c2C[C@H]4…
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) | 4.95 | 3.31 | -111.4 | 3 | 3 | 2 | 24 | 395.513 | 5 | ↓ |