In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2012 | 18 | Yes |
Popular Name: 3-[(S)-hydroxy(phenyl)methyl]-7H-imidazo[1,5-a]pyrazin-8-one 3-[(S)-hydroxy(phenyl)methyl]-7H…
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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) | 0.68 | 2.98 | -14.71 | 2 | 5 | 0 | 70 | 241.25 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.68 | 3.63 | -38.31 | 3 | 5 | 1 | 72 | 242.258 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.