UCSF

ZINC35503359

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2009 21 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) 1.92 6.4 -54.02 3 4 1 59 282.367 3
Hi High (pH 8-9.5) 1.92 5.33 -9.14 2 4 0 54 281.359 3

Activity (Go SEA)

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