UCSF

ZINC01649869

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 33 Yes

CAS Numbers: 13364-94-8 , [13364-94-8]

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) 3.34 5.66 -12.06 0 10 0 104 462.451 9

Activity (Go SEA)

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