UCSF

ZINC08782042

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2007 30 No

Popular Name: ethyl 4-(4-chlorobenzoyl)-8-phenyl-1-thia-4-azaspiro[4.5]decane-3-carboxylate ethyl 4-(4-chlorobenzoyl)-8-phen…

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CAS Number: 1030920-60-5

Other Names:

MFCD04125121

Download: MOL2 SDF SMILES Flexibase

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) 5.25 0.92 -11.28 0 4 0 46 443.996 5 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 127 - 129 KeyOrganics

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