UCSF

ZINC20674655

Substance Information

In ZINC since Heavy atoms Benign functionality
November 27th, 2008 35 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) 3.04 9.21 -18.91 1 9 0 93 478.549 7
Mid Mid (pH 6-8) 3.04 11.49 -64.83 2 9 1 94 479.557 7

Activity (Go SEA)

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