UCSF

ZINC20744553

Substance Information

In ZINC since Heavy atoms Benign functionality
November 28th, 2008 26 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) 1.87 7.4 -15.97 1 7 0 85 367.434 3
Ref Reference (pH 7) 1.68 9.84 -14.88 1 7 0 82 367.434 3

Activity (Go SEA)

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