UCSF

ZINC52893343

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2010 24 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

    None

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) 2.34 8.84 -10.21 1 4 0 47 355.488 4
Lo Low (pH 4.5-6) 2.34 9.3 -41.36 2 4 1 48 356.496 4

Activity (Go SEA)

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