UCSF

ZINC21698023

Substance Information

In ZINC since Heavy atoms Benign functionality
December 8th, 2008 25 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) 0.34 4.98 -42.75 3 7 1 77 347.439 8
Hi High (pH 8-9.5) 0.34 2.01 -8.95 2 7 0 76 346.431 8

Activity (Go SEA)

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