UCSF

ZINC00572903

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 17 Yes

Other Names:

MFCD04073051

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) 2.78 6.53 -33.38 1 3 1 27 249.721 1
Hi High (pH 8-9.5) 2.78 6.11 -5.03 0 3 0 25 248.713 1

Activity (Go SEA)

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