UCSF

ZINC03977841

Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2005 23 No

CAS Number: 4245-41-4

Other Names:

BRD-A23226398-001-02-7

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) 4.13 8.89 -7.96 1 3 0 47 314.425 2

Vendor Notes

Note Type Comments Provided By
Therapy estrogen SMDC MicroSource

Activity (Go SEA)

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