UCSF

ZINC65748391

Substance Information

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

CAS Numbers: 107133-36-8 , 82834-16-0 , [107133-36-8]

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) 2.02 8.68 -51.77 1 7 -1 99 367.466 9

Vendor Notes

Note Type Comments Provided By
Target RAAS Selleck Chemicals

Activity (Go SEA)

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

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