UCSF

ZINC17122925

Substance Information

In ZINC since Heavy atoms Benign functionality
September 15th, 2008 19 No

Other Names:

MFCD02020286

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) 3.13 8.56 -8.72 0 3 0 37 257.333 1
Ref Reference (pH 7) 3.13 8.51 -7.1 0 3 0 37 257.333 1

Activity (Go SEA)

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