UCSF

ZINC36203957

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 27 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) 1.75 6.71 -21.37 1 6 0 69 386.452 3
Mid Mid (pH 6-8) 1.75 8.9 -64.94 2 6 1 70 387.46 3

Activity (Go SEA)

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