UCSF

ZINC19823638

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2008 16 Yes

Other Names:

MFCD07364957

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) 1.96 4.3 -41.84 2 3 1 29 223.34 7
Mid Mid (pH 6-8) 1.96 5.46 -37.09 2 3 1 26 223.34 7

Activity (Go SEA)

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