In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2011 | 20 | No |
Popular Name: 8-[(2S)-tetrahydropyran-2-carbonyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione 8-[(2S)-tetrahydropyran-2-carbon…
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) | -0.38 | 1.07 | -16.09 | 2 | 7 | 0 | 88 | 281.312 | 1 | ↓ |
Hi High (pH 8-9.5) | -0.19 | -1.57 | -46.61 | 1 | 7 | -1 | 94 | 280.304 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.