UCSF

ZINC35303146

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2009 32 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) 2.93 5.1 -18.12 3 11 0 141 463.516 10
Hi High (pH 8-9.5) 3.11 3.91 -46.37 2 11 -1 147 462.508 10

Activity (Go SEA)

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