UCSF

ZINC22996507

Substance Information

In ZINC since Heavy atoms Benign functionality
December 23rd, 2008 26 Yes

Other Names:

MFCD11501751

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) 6.40 13.35 -9.05 0 2 0 18 340.422 6

Vendor Notes

Note Type Comments Provided By
melting_point 158 - 160 KeyOrganics

Activity (Go SEA)

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