UCSF

ZINC36156895

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 34 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 3.42 7.57 -17.42 2 7 0 92 479.602 10
Mid Mid (pH 6-8) 3.42 10.27 -57.75 3 7 1 93 480.61 10

Activity (Go SEA)

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