UCSF

ZINC04130693

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2005 22 No

Other Names:

MFCD01115728

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) 3.82 -1.29 -17.25 1 6 0 91 320.37 4
Hi High (pH 8-9.5) 3.82 -0.71 -52.05 0 6 -1 94 319.362 4

Activity (Go SEA)

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