UCSF

ZINC65496718

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 26 Yes

Popular Name: N-[[4-(dimethylamino)tetrahydropyran-4-yl]methyl]-5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-amin N-[[4-(dimethylamino)tetrahydrop…

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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) 3.31 10.06 -37.13 2 6 1 55 354.478 5 ↓
Hi High (pH 8-9.5) 3.31 7.89 -6.39 1 6 0 54 353.47 5 ↓
Mid Mid (pH 6-8) 3.31 10.46 -90.82 3 6 2 56 355.486 5 ↓

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

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