UCSF

ZINC08407940

Substance Information

In ZINC since Heavy atoms Benign functionality
July 13th, 2006 33 No

Other Names:

MFCD01460190

Download: MOL2 SDF SMILES Flexibase

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) 8.09 2.12 -11.8 1 0 0 52 464.679 5
Lo Low (pH 4.5-6) 8.09 2.19 -38.09 1 5 1 54 465.687 16

Activity (Go SEA)

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