In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 12th, 2013 | 17 | Yes |
Popular Name: 2-AMINO-3-METHYL-3H-IMIDAZO[4,5-F]QUINOXALINE 2-AMINO-3-METHYL-3H-IMIDAZO[4,5-…
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CAS Number: 108354-47-8
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) | -2.92 | 3.61 | -44.25 | 2 | 5 | 1 | 58 | 228.279 | 1 | ↓ |
Lo Low (pH 4.5-6) | -2.92 | 4.21 | -117.82 | 3 | 5 | 2 | 60 | 229.287 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.