UCSF

ZINC01392564

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 11 Yes

Other Names:

MFCD01443821

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) 1.16 4.79 -11.64 0 3 0 43 150.133 0

Vendor Notes

Note Type Comments Provided By
melting_point 119 - 120 KeyOrganics

Activity (Go SEA)

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