UCSF

ZINC21991982

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2008 20 Yes

CAS Numbers: 16965-06-3 , 6404-26-8

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) 0.90 2.93 -60.1 2 7 -1 108 287.336 9

Vendor Notes

Note Type Comments Provided By
Purity 98% min APIChem

Activity (Go SEA)

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