UCSF

ZINC38582588

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 32 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) 5.65 9.93 -41.14 3 7 1 82 509.464 4
Hi High (pH 8-9.5) 5.65 10.54 -43.95 2 7 0 85 508.456 4

Activity (Go SEA)

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