UCSF

ZINC03831129

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2005 32 No

CAS Number: 84371-65-3

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) 5.60 1.03 -9.97 1 3 0 40 429.604 2
Ref Reference (pH 7) 6.34 10.12 -7.55 2 3 0 44 429.604 2
Lo Low (pH 4.5-6) 6.34 10.89 -71.38 3 3 0 45 430.612 2

Vendor Notes

Note Type Comments Provided By
MP 195 TCI
Purity 99% APIChem
Therapy progesterone antagonist, abortion inducer SMDC Pharmakon

Activity (Go SEA)

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