UCSF

ZINC20036767

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2008 11 Yes

Other Names:

MFCD09263665

N/A

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) 1.55 4.76 -36.09 2 3 1 43 160.237 6
Mid Mid (pH 6-8) 1.55 3.48 -4.55 1 3 0 38 159.229 6

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.