UCSF

ZINC08440797

Substance Information

In ZINC since Heavy atoms Benign functionality
July 15th, 2006 31 No

Other Names:

MFCD03213656

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) 4.43 0.16 -13.84 1 6 0 79 437.517 9
Mid Mid (pH 6-8) 3.84 0.03 -20.6 0 6 0 76 437.517 9

Activity (Go SEA)

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