UCSF

ZINC37853326

Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2009 20 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) 4.33 9.72 -34.13 2 3 1 43 276.4 6
Mid Mid (pH 6-8) 4.33 8.73 -4.02 1 3 0 38 275.392 6

Activity (Go SEA)

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