In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 12th, 2012 | 23 | Yes |
Popular Name: 5-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]-3H-1,3-benzoxazol-2-one 5-[4-(3,3-dimethylbutanoyl)piper…
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) | 2.44 | 5.91 | -14.26 | 1 | 6 | 0 | 70 | 317.389 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.90 | 3.27 | -54.61 | 0 | 6 | -1 | 73 | 316.381 | 3 | ↓ |