UCSF

ZINC36637426

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 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) 5.80 14.37 -54.63 1 6 1 60 483.617 7
Hi High (pH 8-9.5) 5.80 11.92 -19.3 0 6 0 59 482.609 7

Activity (Go SEA)

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