In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2011 | 20 | No |
Popular Name: 8-[2-(ethylamino)-2-methyl-propanoyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione 8-[2-(ethylamino)-2-methyl-propa…
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) | -0.29 | -0.22 | -44.53 | 4 | 7 | 1 | 95 | 283.352 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.10 | -2.8 | -43.52 | 2 | 7 | -1 | 97 | 281.336 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.29 | -0.15 | -10.62 | 3 | 7 | 0 | 91 | 282.344 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.10 | -2.88 | -63.84 | 3 | 7 | 0 | 101 | 282.344 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.