UCSF

ZINC60120056

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2011 45 No

Popular Name: (2S)-2-[[2-[5-[ethyl(methyl)BLAHyl]-2,4-dioxo-pyrimidin-1-yl]pyrimidine-4-carbonyl]amino]-2-(2H-tetr (2S)-2-[[2-[5-[ethyl(methyl)BLAH…

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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) 1.00 13.14 -116.9 3 15 -2 215 604.587 8 ↓
Hi High (pH 8-9.5) 1.46 10.51 -196.65 2 15 -3 218 603.579 8 ↓
Mid Mid (pH 6-8) 1.00 13.25 -48.98 4 15 -1 216 605.595 8 ↓

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

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