UCSF

ZINC36366007

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2009 25 No

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) 2.94 3.89 -13.89 3 6 0 90 359.451 4
Ref Reference (pH 7) 2.76 6.26 -13.77 3 6 0 86 359.451 4

Activity (Go SEA)

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