UCSF

ZINC04631913

Substance Information

In ZINC since Heavy atoms Benign functionality
December 15th, 2005 26 No

Other Names:

MFCD02070741

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) 2.70 4.39 -63.49 2 5 1 99 352.368 1
Mid Mid (pH 6-8) 2.70 4.21 -113.65 3 5 2 101 353.376 1

Activity (Go SEA)

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