| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 27th, 2010 | 21 | No |
Popular Name: 3-(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)-5-(3H-pyrazol-4-yl)-1,2,4-oxadiazole 3-(3-methyl-5,6,7,8-tetrahydro-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) | 0.33 | 1.67 | -50.99 | 2 | 7 | 1 | 93 | 283.315 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.33 | 2.1 | -109.37 | 3 | 7 | 2 | 94 | 284.323 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.33 | -1.12 | -8.33 | 1 | 7 | 0 | 89 | 282.307 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.33 | -0.7 | -36.16 | 2 | 7 | 1 | 90 | 283.315 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
