UCSF

ZINC05841465

Substance Information

In ZINC since Heavy atoms Benign functionality
February 17th, 2006 10 Yes

CAS Number: 59734-23-5

Other Names:

MFCD00046686

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) 3.29 -0.09 -1.54 1 1 0 20 144.258 5

Activity (Go SEA)

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