UCSF

ZINC17094071

Substance Information

In ZINC since Heavy atoms Benign functionality
September 13th, 2008 30 No

Other Names:

MFCD02954520

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) 6.67 12.6 -10.48 0 5 0 53 424.566 9
Ref Reference (pH 7) 6.67 13.34 -10 0 5 0 53 424.566 9

Activity (Go SEA)

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