In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2010 | 19 | Yes |
Popular Name: 3-[(1R)-tetralin-1-yl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine 3-[(1R)-tetralin-1-yl]-5,6,7,8-t…
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) | 1.44 | 7.56 | -57.59 | 2 | 4 | 1 | 47 | 255.345 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.44 | 6.21 | -11.28 | 1 | 4 | 0 | 43 | 254.337 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.