In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2010 | 19 | Yes |
Popular Name: N-[(1R)-4-fluoroindan-1-yl]-5-oxo-1,2-dihydro-1,2,4-triazole-3-carboxamide N-[(1R)-4-fluoroindan-1-yl]-5-ox…
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) | 0.30 | 1.96 | -9.72 | 3 | 6 | 0 | 91 | 262.244 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.75 | -0.58 | -46.93 | 2 | 6 | -1 | 94 | 261.236 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.75 | 0.51 | -24.63 | 3 | 6 | 0 | 95 | 262.244 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.