UCSF

ZINC53632256

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2010 27 No

Popular Name: 6-[(4aS)-4-oxo-2-thioxo-4aH-quinazolin-3-yl]-N-[2-(1H-imidazol-5-yl)ethyl]hexanamide 6-[(4aS)-4-oxo-2-thioxo-4aH-quin…

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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) 1.34 9.2 -53.69 3 7 1 92 386.501 9 ↓
Mid Mid (pH 6-8) 1.34 8.73 -28.9 2 7 0 90 385.493 9 ↓

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

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