UCSF

ZINC19815578

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2008 23 Yes

Other Names:

MFCD01928358

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) -0.78 0.7 -10.66 1 7 0 69 320.393 4
Mid Mid (pH 6-8) -0.78 3 -44.38 2 7 1 70 321.401 4

Activity (Go SEA)

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