UCSF

ZINC79405417

Substance Information

In ZINC since Heavy atoms Benign functionality
October 18th, 2012 16 Yes

Other Names:

MFCD21093945

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) 0.16 3.09 -39.56 2 4 1 45 229.344 4

Activity (Go SEA)

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