UCSF

ZINC44126623

Substance Information

In ZINC since Heavy atoms Benign functionality
May 22nd, 2010 22 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) -1.01 2.86 -33.51 5 7 0 126 331.438 6
Hi High (pH 8-9.5) -1.01 2.51 -45.42 4 7 -1 124 330.43 6

Activity (Go SEA)

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