UCSF

ZINC01396299

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2005 16 No

Other Names:

MFCD03617655

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) 3.02 2.09 -42.69 0 5 -1 86 222.22 5

Vendor Notes

Note Type Comments Provided By
melting_point 72 - 74 KeyOrganics

Activity (Go SEA)

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