UCSF

ZINC67437377

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 9th, 2011 27 No

Popular Name: (4S)-N-(2-ethylphenyl)-4-(3-fluoro-4-methyl-phenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-ca (4S)-N-(2-ethylphenyl)-4-(3-fluo…

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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) 4.88 10.47 -13.81 3 4 0 53 383.492 4 ↓
Hi High (pH 8-9.5) 4.69 10.06 -37.64 2 4 -1 59 382.484 4 ↓

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

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