UCSF

ZINC04261771

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2005 23 No

CAS Numbers: 528-50-7 , [528-50-7]

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) -4.45 -15.97 -14.75 8 11 0 190 342.297 4

Activity (Go SEA)

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