UCSF

ZINC39699657

Substance Information

In ZINC since Heavy atoms Benign functionality
March 4th, 2010 20 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) -1.17 -7.58 -52.19 3 9 -1 128 299.288 2
Mid Mid (pH 6-8) -1.17 -8.34 -16.82 3 9 0 128 300.296 2

Activity (Go SEA)

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