UCSF

ZINC36184588

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 40 No

CAS Number: 675576-98-4

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) 5.71 11.71 -12.07 1 8 0 83 581.5 6

Vendor Notes

Note Type Comments Provided By
Patent Database Links WO2007100305 ChEBI

Activity (Go SEA)

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