UCSF

ZINC08398809

Substance Information

In ZINC since Heavy atoms Benign functionality
July 13th, 2006 27 No

Other Names:

MFCD01079880

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) 4.01 9.72 -11.95 0 11 0 146 373.325 9
Ref Reference (pH 7) 4.01 10.7 -14.73 0 11 0 146 373.325 9

Activity (Go SEA)

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

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