UCSF

ZINC04002042

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2005 18 No

Popular Name: methyl 4-chloro-1-(2-thienylsulfonyl)-2-pyrrolidinecarboxylate methyl 4-chloro-1-(2-thienylsulf…

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CAS Number: 251310-47-1

Other Names:

MFCD01935823

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) 1.77 -3.2 -16.38 0 5 0 63 309.796 4 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 81 - 83 KeyOrganics

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