UCSF

ZINC08400683

Substance Information

In ZINC since Heavy atoms Benign functionality
July 13th, 2006 33 No

Other Names:

MFCD03080991

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) 6.05 13.39 -53.04 0 7 -1 97 481.937 7
Ref Reference (pH 7) 6.05 13.31 -56.37 0 7 -1 97 481.937 7

Activity (Go SEA)

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