In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: (2S)-N-[[(2S)-tetrahydrofuran-2-yl]methyl]-N-(2-thienylmethyl)piperidine-2-carboxamide (2S)-N-[[(2S)-tetrahydrofuran-2-…
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) | 2.02 | 7.78 | -37.12 | 2 | 4 | 1 | 46 | 309.455 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.02 | 6.02 | -9.51 | 1 | 4 | 0 | 42 | 308.447 | 5 | ↓ |