In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 32 | Yes |
Popular Name: N-benzyl-N-[3-[2-oxo-2-(3-pyridylmethylamino)ethyl]phenyl]cyclopentanecarboxamide N-benzyl-N-[3-[2-oxo-2-(3-pyridy…
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) | 3.97 | 11.82 | -16.83 | 1 | 5 | 0 | 62 | 427.548 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.97 | 12.29 | -49.87 | 2 | 5 | 1 | 64 | 428.556 | 8 | ↓ |