UCSF

ZINC05683444

Substance Information

In ZINC since Heavy atoms Benign functionality
February 9th, 2006 18 No

Other Names:

MFCD01316010

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 0.76 -4.79 -47.95 2 4 1 58 270.374 4

Vendor Notes

Note Type Comments Provided By
melting_point 139 - 141 KeyOrganics

Activity (Go SEA)

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

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