UCSF

ZINC03946345

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2005 34 No

CAS Number: 5289-74-7

Other Names:

BRD-A46778020-001-02-6

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) 1.36 -1.75 -12.22 6 7 0 138 480.642 5

Vendor Notes

Note Type Comments Provided By
Therapy insect molting hormone SMDC MicroSource
PUBCHEM_PATENT_ID US5609873 IBM Patent Data

Activity (Go SEA)

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