UCSF

ZINC22743488

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 34 Yes

Popular Name: (6S)-N-(3-chloro-4-fluoro-phenyl)-1-(4-ethylphenyl)-3-isobutyl-8-oxo-2,4,6,7-tetrahydropyrimido[2,3- (6S)-N-(3-chloro-4-fluoro-phenyl…

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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) 6.12 12.42 -25.86 1 7 0 68 485.991 6 ↓
Lo Low (pH 4.5-6) 6.12 14.51 -70.58 2 7 1 69 486.999 6 ↓

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

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