UCSF

ZINC34833282

Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2009 29 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 4.07 10.08 -10.99 1 6 0 72 385.471 5
Lo Low (pH 4.5-6) 4.07 10.49 -37.32 2 6 1 73 386.479 5

Activity (Go SEA)

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