In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 22 | Yes |
Popular Name: (3S)-1-(5-tert-butyl-1,3-benzoxazol-2-yl)piperidine-3-carboxylic (3S)-1-(5-tert-butyl-1,3-benzoxa…
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) | 3.66 | 8.04 | -47.57 | 0 | 5 | -1 | 69 | 301.366 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.66 | 8.17 | -41.93 | 1 | 5 | 0 | 71 | 302.374 | 3 | ↓ |