UCSF

ZINC14264066

Substance Information

In ZINC since Heavy atoms Benign functionality
July 6th, 2008 25 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) 1.48 5.65 -14.41 1 7 0 73 343.383 5
Lo Low (pH 4.5-6) 1.48 6.1 -46.34 2 7 1 74 344.391 5

Activity (Go SEA)

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