UCSF

ZINC19684084

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2008 22 No

Other Names:

MFCD11584766

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 4.74 -59.88 2 6 1 65 307.37 5
Mid Mid (pH 6-8) 0.94 3.37 -13.41 1 6 0 60 306.362 5

Activity (Go SEA)

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