UCSF

ZINC19721015

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2008 19 No

Popular Name: CBI-BBZERO/001790 CBI-BBZERO/001790

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CAS Number: 104720-70-9

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) 3.24 8.27 -9.14 1 4 0 58 256.305 6 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0798292A1 IBM Patent Data

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