UCSF

ZINC79405287

Substance Information

In ZINC since Heavy atoms Benign functionality
October 18th, 2012 14 Yes

Other Names:

MFCD21093913

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) -0.51 2.13 -42.15 2 4 1 45 201.29 3

Activity (Go SEA)

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