In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2011 | 24 | Yes |
Popular Name: 1-[(1S)-2-(tert-butylamino)-1-methyl-2-oxo-ethyl]-N-(2-furylmethyl)piperidine-4-carboxamide 1-[(1S)-2-(tert-butylamino)-1-me…
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) | 1.50 | 5.73 | -45.21 | 3 | 6 | 1 | 76 | 336.456 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.87 | -1.18 | -7.65 | 2 | 6 | 0 | 82 | 335.448 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.50 | 3.51 | -12.73 | 2 | 6 | 0 | 75 | 335.448 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.