UCSF

ZINC19848754

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2008 35 No

Other Names:

MFCD03700355

Download: MOL2 SDF SMILES Flexibase

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) 2.00 4.19 -64.14 1 9 -1 112 481.525 9
Mid Mid (pH 6-8) 2.00 6.59 -79.78 2 9 0 113 482.533 9

Activity (Go SEA)

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