UCSF

ZINC03843535

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 20 No

CAS Number: 963-74-6

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) 4.81 2.14 -3.9 0 1 0 17 274.448 0

Vendor Notes

Note Type Comments Provided By
mp 120 - 121 MolMall (formerly Molecular Diversity Preservation International)
mp 123 - 125 MolMall (formerly Molecular Diversity Preservation International)

Activity (Go SEA)

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

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