UCSF

ZINC34476261

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2009 32 No

Popular Name: 7-chloro-3-[4-(7-chloro-4-oxo-2-thioxo-1H-quinazolin-3-yl)phenyl]-2-thioxo-1H-quinazolin-4-one 7-chloro-3-[4-(7-chloro-4-oxo-2-…

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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) 5.45 13.18 -93.6 0 6 -2 70 497.388 2 ↓
Mid Mid (pH 6-8) 4.72 13.49 -48.22 1 6 -1 73 498.396 2 ↓
Lo Low (pH 4.5-6) 4.00 13.79 -18.1 2 6 0 76 499.404 2 ↓

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