UCSF

ZINC03843731

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 23 No

Popular Name: 17-ethynyl-17-hydroxy-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenan 17-ethynyl-17-hydroxy-10,13-dime…

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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) 3.66 1.14 -6.96 1 2 0 37 314.469 0 ↓

Vendor Notes

Note Type Comments Provided By
mp 202 - 204 MolMall (formerly Molecular Diversity Preservation International)
mp 220 - 221 MolMall (formerly Molecular Diversity Preservation International)

Activity (Go SEA)

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