UCSF

ZINC23364575

Substance Information

In ZINC since Heavy atoms Benign functionality
December 30th, 2008 23 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) 2.69 8.13 -23.58 1 6 0 73 333.413 5
Hi High (pH 8-9.5) 2.87 7.31 -48.28 0 6 -1 80 332.405 5

Activity (Go SEA)

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