UCSF

ZINC02783542

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2004 33 No

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) 1.98 4.92 -18.49 1 11 0 130 451.439 8
Ref Reference (pH 7) 1.98 5.33 -20.44 1 11 0 130 451.439 8
Ref Reference (pH 7) 1.98 4.95 -20.22 1 11 0 130 451.439 8
Ref Reference (pH 7) 1.98 5.94 -25.94 1 11 0 130 451.439 8

Activity (Go SEA)

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