UCSF

ZINC08440144

Substance Information

In ZINC since Heavy atoms Benign functionality
July 15th, 2006 45 No

Other Names:

MFCD03783730

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) 6.34 -0.33 -17.85 1 9 0 107 622.699 11
Mid Mid (pH 6-8) 5.75 -0.44 -22.26 0 9 0 104 622.699 11

Activity (Go SEA)

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