In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2008 | 25 | No |
Popular Name: 2-[[[(3S)-1,1-dioxothiolan-3-yl]-propyl-amino]methyl]-2,4-diazaspiro[4.6]undecane-1,3-dione 2-[[[(3S)-1,1-dioxothiolan-3-yl]…
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) | 2.07 | 3.03 | -14.36 | 1 | 7 | 0 | 87 | 371.503 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.07 | 5.26 | -51.89 | 2 | 7 | 1 | 88 | 372.511 | 5 | ↓ |