UCSF

ZINC31494318

Substance Information

In ZINC since Heavy atoms Benign functionality
April 11th, 2009 19 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 5.92 12.4 -3.44 0 2 0 26 288.497 14
Hi High (pH 8-9.5) 5.92 12.94 -40.57 0 2 -1 26 287.489 14

Activity (Go SEA)

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