UCSF

ZINC03722619

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 16 No

Other Names:

MFCD01764385

QA-4152

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) 3.42 5.66 -6.23 2 3 0 48 275.16 2
Lo Low (pH 4.5-6) 3.42 5.71 -30.03 3 3 1 49 276.168 2

Activity (Go SEA)

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