UCSF

ZINC03051240

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2004 27 Yes

Other Names:

MFCD00665708

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) 6.99 1.94 -8.1 0 2 0 17 393.317 4

Vendor Notes

Note Type Comments Provided By
melting_point 130 - 133 KeyOrganics

Activity (Go SEA)

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