UCSF

ZINC05665360

Substance Information

In ZINC since Heavy atoms Benign functionality
February 9th, 2006 39 No

CAS Numbers: 58546-56-8 , [58546-56-8]

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) 5.63 2.43 -16.87 1 9 0 101 536.577 7

Activity (Go SEA)

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