UCSF

ZINC55279608

Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2010 24 Yes

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) 1.70 7.19 -55.91 1 6 1 68 356.443 7
Hi High (pH 8-9.5) 1.70 4.54 -12.01 0 6 0 67 355.435 7

Activity (Go SEA)

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