In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 27th, 2010 | 21 | No |
Popular Name: (2S)-1-[2-(4-amino-N-methyl-anilino)-2-oxo-ethyl]piperidine-2-carboxamide (2S)-1-[2-(4-amino-N-methyl-anil…
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) | 0.66 | 2.96 | -39.38 | 5 | 6 | 1 | 94 | 291.375 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.66 | 0.96 | -17.35 | 4 | 6 | 0 | 93 | 290.367 | 4 | ↓ |