UCSF

ZINC65527853

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 23 Yes

Popular Name: N-[2-[(4R)-4H-imidazol-4-yl]ethyl]-5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-amine N-[2-[(4R)-4H-imidazol-4-yl]ethy…

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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) 2.87 10.27 -38.31 3 6 1 71 307.381 5 ↓
Mid Mid (pH 6-8) 2.87 9.8 -12.95 2 6 0 70 306.373 5 ↓
Lo Low (pH 4.5-6) 2.87 10.66 -81.77 4 6 2 72 308.389 5 ↓

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

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