UCSF

ZINC39733101

Substance Information

In ZINC since Heavy atoms Benign functionality
March 6th, 2010 26 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) 2.17 7.54 -15.59 0 6 0 72 371.462 7
Lo Low (pH 4.5-6) 2.17 9.92 -40.58 1 6 1 74 372.47 7

Activity (Go SEA)

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