UCSF

ZINC05816604

Substance Information

In ZINC since Heavy atoms Benign functionality
February 15th, 2006 23 No

Other Names:

MFCD01202505

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) 2.98 4.91 -19.19 2 6 0 80 314.341 6
Hi High (pH 8-9.5) 2.98 5.68 -69.26 1 6 -1 83 313.333 6

Activity (Go SEA)

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