UCSF

ZINC00135357

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 21 Yes

Popular Name: 2-{[5-(furan-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid 2-{[5-(furan-2-yl)-4-phenyl-4H-1…

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CAS Number: 307327-52-2

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) 2.15 1.93 -52.16 0 6 -1 83 300.319 5 ↓

Vendor Notes

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

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