UCSF

ZINC45703166

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2010 19 No

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) 3.19 7.33 -41.01 1 3 1 21 304.911 9
Hi High (pH 8-9.5) 3.19 4.87 -3.9 0 3 0 19 303.903 9

Activity (Go SEA)

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