In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2011 | 18 | Yes |
Popular Name: 1-[(3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)methyl]cyclohexanol 1-[(3-methyl-6,8-dihydro-5H-[1,2…
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) | 0.66 | 6.68 | -49.41 | 2 | 5 | 1 | 55 | 251.354 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.66 | 4.94 | -12.15 | 1 | 5 | 0 | 54 | 250.346 | 2 | ↓ |