UCSF

ZINC00704170

Substance Information

In ZINC since Heavy atoms Benign functionality
November 28th, 2005 26 No

Other Names:

MFCD01412773

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) 4.04 10.63 -22.99 1 6 0 95 382.832 5
Ref Reference (pH 7) 4.04 10.5 -26.24 1 6 0 95 382.832 5

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.