UCSF

ZINC67172428

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 6th, 2011 32 No

Popular Name: ethyl (9Z)-9-benzylidene-3-methyl-5-phenyl-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline-2-carboxylate ethyl (9Z)-9-benzylidene-3-methy…

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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) 7.72 17.39 -8.38 0 4 0 44 442.584 5 ↓
Mid Mid (pH 6-8) 7.72 17.37 -21.64 1 4 1 45 443.592 5 ↓

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

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