UCSF

ZINC01555351

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2004 20 No

Popular Name: Bis(2-nitrophenyl) disulfide Bis(2-nitrophenyl) disulfide

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CAS Numbers: 1155-00-6 , [1155-00-6]

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) 4.23 1.5 -15.18 0 6 0 91 308.34 5 ↓

Vendor Notes

Note Type Comments Provided By
MP 192 TCI
Purity 98%min APIChem

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50607-4-O Human Immunodeficiency Virus 1 (cluster #4 Of 10), Other Other 13 0.55 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z50607 Z50607 Human Immunodeficiency Virus 1 13.1 0.55 Functional ≤ 10μM

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