UCSF

ZINC08833472

Substance Information

In ZINC since Heavy atoms Benign functionality
July 29th, 2007 28 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) 4.80 10.42 -20.22 2 7 0 104 372.384 4
Lo Low (pH 4.5-6) 4.80 10.84 -40.86 3 7 1 105 373.392 4

Activity (Go SEA)

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