In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 20 | No |
Popular Name: 8-[(2R,3S)-2-amino-3-methyl-pentanoyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione 8-[(2R,3S)-2-amino-3-methyl-pent…
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) | -0.77 | -0.91 | -53.07 | 5 | 7 | 1 | 106 | 283.352 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.58 | -3.55 | -73.4 | 4 | 7 | 0 | 112 | 282.344 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.77 | -1.22 | -11.32 | 4 | 7 | 0 | 105 | 282.344 | 3 | ↓ |