UCSF

ZINC11821248

Substance Information

In ZINC since Heavy atoms Benign functionality
March 12th, 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) 0.67 -2.31 -41.38 2 7 1 76 319.385 4
Lo Low (pH 4.5-6) 0.67 -2.2 -106.92 3 7 2 77 320.393 4

Activity (Go SEA)

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