UCSF

ZINC26186622

Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2009 28 Yes

CAS Numbers: 175414-77-4 , 175519-16-1

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) 0.20 6.81 -92.5 2 9 0 117 401.448 5
Hi High (pH 8-9.5) 0.20 5.46 -59.03 1 9 -1 112 400.44 5

Vendor Notes

Note Type Comments Provided By
Target Topoisomerase Selleck Chemicals

Activity (Go SEA)

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