UCSF

ZINC36097634

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 18 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 1.61 5.57 -33.54 2 4 1 51 250.318 6
Mid Mid (pH 6-8) 1.61 3.49 -6.31 1 4 0 50 249.31 6

Activity (Go SEA)

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