UCSF

ZINC14256771

Substance Information

In ZINC since Heavy atoms Benign functionality
July 5th, 2008 23 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 1.31 0.32 -21.25 3 9 0 152 357.369 5
Hi High (pH 8-9.5) 1.31 0.41 -52.94 2 9 -1 154 356.361 5

Activity (Go SEA)

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