UCSF

ZINC01871889

Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2004 16 No

CAS Numbers: 68133-60-8 , [15990-43-9]

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) -2.39 1.89 -48.92 0 3 0 44 213.236 3

Activity (Go SEA)

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