UCSF

ZINC36395394

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 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) 2.00 7.52 -41.15 2 6 1 79 278.332 7
Mid Mid (pH 6-8) 2.00 5.82 -15.49 1 6 0 78 277.324 7

Activity (Go SEA)

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