UCSF

ZINC04998081

Substance Information

In ZINC since Heavy atoms Benign functionality
January 14th, 2006 20 Yes

Other Names:

MFCD07409192

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) 1.75 -0.42 -47.45 2 4 1 47 273.356 7

Activity (Go SEA)

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