UCSF

ZINC03894979

Substance Information

In ZINC since Heavy atoms Benign functionality
October 15th, 2005 24 No

Other Names:

MFCD03066135

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) 5.26 2.12 -42.37 1 2 1 21 359.276 2

Vendor Notes

Note Type Comments Provided By
melting_point 130 - 131 KeyOrganics

Activity (Go SEA)

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