UCSF

ZINC37382609

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2009 21 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) 4.04 5.38 -5.39 0 4 0 41 416.168 4
Mid Mid (pH 6-8) 4.04 7.59 -41.35 1 4 1 42 417.176 4

Activity (Go SEA)

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