UCSF

ZINC08450495

Substance Information

In ZINC since Heavy atoms Benign functionality
July 16th, 2006 32 No

Other Names:

MFCD03083317

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) 7.75 16.51 -7.85 0 4 0 39 443.616 4
Ref Reference (pH 7) 7.75 15.41 -7.8 0 4 0 39 443.616 4

Activity (Go SEA)

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