UCSF

ZINC36693528

Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2009 35 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 2.89 1.85 -23.41 1 11 0 143 521.621 10
Hi High (pH 8-9.5) 2.95 -0.27 -54.19 0 11 -1 149 520.613 10

Activity (Go SEA)

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