In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 17 | Yes |
Popular Name: (1S)-1-(5-tert-butyl-1,3-benzoxazol-2-yl)propan-1-amine (1S)-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) | 2.02 | 3.31 | -44.04 | 3 | 3 | 1 | 54 | 233.335 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.02 | 2.97 | -6.81 | 2 | 3 | 0 | 52 | 232.327 | 3 | ↓ |