UCSF

ZINC26363457

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 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) 4.00 4.1 -22.6 2 9 0 131 508.581 9
Hi High (pH 8-9.5) 4.00 4.17 -48.7 1 9 -1 133 507.573 9

Activity (Go SEA)

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