UCSF

ZINC04452955

Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 2005 28 No

Other Names:

MFCD03234823

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) 1.17 -1.59 -19.55 3 8 0 156 375.388 4
Mid Mid (pH 6-8) 1.17 -1.76 -48.42 4 8 1 158 376.396 4

Activity (Go SEA)

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