UCSF

ZINC35283351

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2009 33 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) 2.99 10.22 -75.17 1 8 0 100 452.507 10
Lo Low (pH 4.5-6) 2.99 9.46 -55.64 2 8 1 98 453.515 10

Activity (Go SEA)

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