UCSF

ZINC59150280

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 26th, 2011 13 No

Popular Name: Tirapazamine Tirapazamine

Find On: PubMed — Wikipedia — Google

CAS Number: 27314-97-2

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) -4.25 2.82 -26.39 3 6 1 88 179.159 0 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0649658A1; EP0649658B1; EP0865435A1; EP0912535A1; EP0914116A1; EP0914116B1; EP0972517A2; EP0972517A3; EP1014990A1; EP1017835A1; EP1054998A1; US5484612; US5597582; US5637085; US5652255; US5670502; US5672702; US5795909; US5827850; US5919815; US6013646; US IBM Patent Data

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

No pre-computed analogs available. Try a structural similarity search.