UCSF

ZINC14520899

Substance Information

In ZINC since Heavy atoms Benign functionality
July 11th, 2008 27 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) 1.44 6.42 -54.68 2 7 1 84 389.501 5
Mid Mid (pH 6-8) 1.44 4.07 -22.02 1 7 0 83 388.493 5

Activity (Go SEA)

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