UCSF

ZINC38655435

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 22 Yes

Other Names:

F3401-0003

MFCD16640725

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) 1.44 6.34 -48.53 1 7 -1 96 304.326 6
Mid Mid (pH 6-8) 1.44 6.76 -36.67 2 7 0 98 305.334 6

Activity (Go SEA)

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