In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 13th, 2011 | 25 | Yes |
Popular Name: 1-[2-(4-tert-butylanilino)-2-oxo-ethyl]-N,N-dimethyl-piperidine-4-carboxamide 1-[2-(4-tert-butylanilino)-2-oxo…
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) | 2.90 | 9.07 | -53.54 | 2 | 5 | 1 | 54 | 346.495 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.90 | 6.89 | -17.93 | 1 | 5 | 0 | 53 | 345.487 | 5 | ↓ |