UCSF

ZINC38537253

Substance Information

In ZINC since Heavy atoms Benign functionality
January 26th, 2010 17 Yes

Other Names:

MFCD11504984

N/A

NA

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) 1.04 4.82 -58.31 2 3 1 42 236.245 4
Mid Mid (pH 6-8) 1.04 3.46 -6.72 1 3 0 38 235.237 4

Activity (Go SEA)

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