UCSF

ZINC08441149

Substance Information

In ZINC since Heavy atoms Benign functionality
July 15th, 2006 39 No

Other Names:

MFCD04147939

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) 3.68 0.8 -15.66 1 10 0 128 548.573 8
Mid Mid (pH 6-8) 3.10 0.59 -17.44 0 10 0 125 548.573 8

Activity (Go SEA)

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