UCSF

ZINC04649627

Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2005 23 No

Other Names:

MFCD05883218

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) 2.91 5.66 -17.01 2 7 0 95 309.329 2
Ref Reference (pH 7) 2.91 3.95 -17.81 2 7 0 95 309.329 2

Activity (Go SEA)

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