UCSF

ZINC04535635

Substance Information

In ZINC since Heavy atoms Benign functionality
December 7th, 2005 23 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) 0.03 -3.34 -51.83 4 6 1 94 319.381 7
Mid Mid (pH 6-8) -0.56 -3.54 -64.4 3 6 1 91 319.381 7

Activity (Go SEA)

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