UCSF

ZINC02383658

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 20 Yes

Other Names:

MFCD01784554

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) 4.68 -2.98 -5.52 2 3 0 41 401.098 4

Vendor Notes

Note Type Comments Provided By
melting_point 106 - 107 KeyOrganics

Activity (Go SEA)

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