UCSF

ZINC28974015

Substance Information

In ZINC since Heavy atoms Benign functionality
March 9th, 2009 28 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) 2.51 8.84 -70.05 3 7 1 110 374.424 7
Hi High (pH 8-9.5) 2.51 6.84 -34.42 2 7 0 109 373.416 7

Activity (Go SEA)

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