UCSF

ZINC26647802

Substance Information

In ZINC since Heavy atoms Benign functionality
February 8th, 2009 19 No

Other Names:

MFCD00058585

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) -0.94 -2.19 -22.68 3 7 0 105 333.138 3
Hi High (pH 8-9.5) -0.48 -3.98 -61.13 2 7 -1 108 332.13 3

Activity (Go SEA)

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