UCSF

ZINC44699886

Substance Information

In ZINC since Heavy atoms Benign functionality
July 21st, 2010 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) -3.03 -0.73 -255.85 3 15 -3 236 481.185 8
Mid Mid (pH 6-8) -3.03 -1.89 -140.37 4 15 -2 233 482.193 8

Activity (Go SEA)

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