UCSF

ZINC04675505

Substance Information

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

Other Names:

MFCD03270348

Download: MOL2 SDF SMILES Flexibase

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) 5.41 12.8 -16.43 1 3 0 46 371.48 3
Mid Mid (pH 6-8) 5.37 2.58 -14.83 0 3 0 46 371.48 3

Activity (Go SEA)

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