UCSF

ZINC00482967

Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2005 24 No

Other Names:

MFCD01247014

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) 1.78 3.46 -17.68 3 10 0 146 333.304 5
Hi High (pH 8-9.5) 1.78 4.47 -57.25 2 10 -1 148 332.296 5

Activity (Go SEA)

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