UCSF

ZINC11997334

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2008 19 No

Popular Name: 6-(3-nitrophenyl)-3,7-dihydropyrrolo[3,2-e]pyrimidin-4-one 6-(3-nitrophenyl)-3,7-dihydropyr…

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CAS Number: N/A

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Physical Representations

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) 1.61 6.57 -16.85 2 7 0 107 256.221 2 ↓
Hi High (pH 8-9.5) 2.07 5.37 -45.34 1 7 -1 110 255.213 2 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.