UCSF

ZINC35199955

Substance Information

In ZINC since Heavy atoms Benign functionality
October 4th, 2009 20 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) -1.12 0.53 -19.12 1 9 0 107 283.288 5
Lo Low (pH 4.5-6) -1.12 2.82 -57.6 2 9 1 109 284.296 5

Activity (Go SEA)

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