UCSF

ZINC14256773

Substance Information

In ZINC since Heavy atoms Benign functionality
July 5th, 2008 23 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) 1.45 -2.57 -18.02 3 8 0 132 370.437 4
Hi High (pH 8-9.5) 1.45 -2.47 -48.34 2 8 -1 134 369.429 4

Activity (Go SEA)

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