UCSF

ZINC36156635

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 35 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) 4.16 11.86 -52.43 3 6 1 80 490.649 10
Mid Mid (pH 6-8) 4.16 9.86 -15.37 2 6 0 78 489.641 10

Activity (Go SEA)

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