UCSF

ZINC08715385

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2007 24 Yes

Other Names:

MFCD06070449

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) 1.72 -3.44 -16.66 1 7 0 90 342.38 7
Lo Low (pH 4.5-6) 1.72 -3.79 -36.95 2 7 1 91 343.388 7

Activity (Go SEA)

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