UCSF

ZINC72099114

Substance Information

In ZINC since Heavy atoms Benign functionality
February 29th, 2012 28 No

Other Names:

MFCD00010483

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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 11.54 -14.27 0 4 0 60 386.532 3

Vendor Notes

Note Type Comments Provided By
MP 206 TCI

Activity (Go SEA)

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

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