In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 15 | Yes |
Popular Name: 6-[[(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]amino]-2H-1,2,4-triazine-3,5-dione 6-[[(1S,5R)-3-azabicyclo[3.1.0]h…
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) | -0.75 | -1.58 | -46.86 | 5 | 7 | 1 | 107 | 210.217 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.29 | -3.25 | -60.05 | 4 | 7 | 0 | 110 | 209.209 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.