UCSF

ZINC49552013

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2010 21 No

Popular Name: 4-imino-2-mercapto-5-(4-methyl-1,3-thiazol-2-yl)-3-azaspiro[5.5]undec-1-ene-1-carbonitrile 4-imino-2-mercapto-5-(4-methyl-1…

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CAS Number: 851207-99-3

Other Names:

MFCD06375936

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) 2.38 5.87 -42.52 3 4 0 74 318.471 1 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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