UCSF

ZINC22789185

Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 38 No

Other Names:

MFCD04149116

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) 0.73 6.38 -16.73 0 10 0 100 520.586 8
Ref Reference (pH 7) 0.73 6.64 -14.65 0 10 0 100 520.586 8
Ref Reference (pH 7) 0.73 6.4 -17.03 0 10 0 100 520.586 8

Activity (Go SEA)

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