UCSF

ZINC34678759

Substance Information

In ZINC since Heavy atoms Benign functionality
September 21st, 2009 34 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) 5.36 15.01 -56.99 1 7 1 80 460.554 7
Mid Mid (pH 6-8) 5.36 12.83 -18.07 0 7 0 79 459.546 7

Activity (Go SEA)

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