In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 19 | Yes |
Popular Name: 6-[(1R,2S)-1-amino-2-ethyl-hexyl]-3H-1,3-benzoxazol-2-one 6-[(1R,2S)-1-amino-2-ethyl-hexyl…
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) | 1.83 | 4.86 | -59.89 | 4 | 4 | 1 | 74 | 263.361 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.29 | 2.23 | -80.9 | 3 | 4 | 0 | 77 | 262.353 | 6 | ↓ |