UCSF

ZINC04084641

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2005 25 Yes

Other Names:

MFCD00717794

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) 5.60 -0.19 -38.88 3 2 1 36 338.515 5

Activity (Go SEA)

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