UCSF

ZINC17163225

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 16th, 2008 25 No

Popular Name: (5E)-1-(3,5-dichlorophenyl)-5-[(2,5-dimethyl-1H-pyrrol-3-yl)methylene]-2-sulfanyl-pyrimidine-4,6-dio (5E)-1-(3,5-dichlorophenyl)-5-[(…

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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) 3.43 8.2 -46.96 1 5 -1 74 393.275 2 ↓
Lo Low (pH 4.5-6) 2.97 9.28 -11.88 2 5 0 71 394.283 2 ↓

Activity (Go SEA)

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