UCSF

ZINC12023765

Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2008 32 Yes

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) 2.38 7.15 -57.49 2 8 1 91 480.01 7
Hi High (pH 8-9.5) 2.38 5.38 -23.74 1 8 0 90 479.002 7

Activity (Go SEA)

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