UCSF

ZINC33956547

Substance Information

In ZINC since Heavy atoms Benign functionality
August 4th, 2009 30 No

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) 3.62 8.16 -40.44 2 7 1 83 412.462 9
Hi High (pH 8-9.5) 3.62 5.64 -12.53 1 7 0 81 411.454 9

Activity (Go SEA)

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