UCSF

ZINC08441137

Substance Information

In ZINC since Heavy atoms Benign functionality
July 15th, 2006 41 No

Other Names:

MFCD04147936

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) 5.64 0.74 -14.52 1 9 0 119 574.655 11
Mid Mid (pH 6-8) 5.06 0.52 -16.88 0 9 0 116 574.655 11

Activity (Go SEA)

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