UCSF

ZINC34404918

Substance Information

In ZINC since Heavy atoms Benign functionality
August 29th, 2009 16 Yes

CAS Number: 130493-12-8

Download: MOL2 SDF SMILES Flexibase

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Vendors

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) 1.91 6.38 -7.23 1 4 0 55 216.24 4

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0506194A1; EP0506194B1; EP0793653A1; US5254575; US5462959; US5633377; US5646281; US5656762; US5712392; US6069251; WO1996016040A1 IBM Patent Data

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