UCSF

ZINC33581496

Substance Information

In ZINC since Heavy atoms Benign functionality
July 13th, 2009 28 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 4.66 11.37 -11.41 1 5 0 59 398.528 7
Lo Low (pH 4.5-6) 4.66 12.16 -34.73 2 5 0 60 399.536 7

Activity (Go SEA)

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