UCSF

ZINC72099478

Substance Information

In ZINC since Heavy atoms Benign functionality
February 29th, 2012 37 No

Other Names:

MFCD06200842

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) 5.04 13.45 -17.23 1 9 0 118 506.507 11

Vendor Notes

Note Type Comments Provided By
MP 143 TCI

Activity (Go SEA)

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

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