UCSF

ZINC08551464

Substance Information

In ZINC since Heavy atoms Benign functionality
August 1st, 2006 24 No

CAS Numbers: 12126-59-9 , 7280-37-7

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) 0.84 5.99 -56.58 0 5 -1 84 349.428 2

Vendor Notes

Note Type Comments Provided By
Therapy estrogen SMDC Pharmakon

Activity (Go SEA)

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