In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2011 | 25 | Yes |
Popular Name: 3-[2-(3-methyl-3,9-diazaspiro[5.6]dodecan-9-yl)ethyl]-1,3-benzoxazol-2-one 3-[2-(3-methyl-3,9-diazaspiro[5.…
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) | 2.45 | 11.47 | -106.59 | 2 | 5 | 2 | 44 | 345.487 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.45 | 9.42 | -42.32 | 1 | 5 | 1 | 43 | 344.479 | 3 | ↓ |