UCSF

ZINC43409573

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 13th, 2010 22 Yes

Popular Name: (1R,4aS,4bR,7S,10aS)-1,4a,7-trimethyl-7-vinyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carbox (1R,4aS,4bR,7S,10aS)-1,4a,7-trim…

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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) 4.96 11.14 -43.34 0 2 -1 40 301.45 2 ↓
Lo Low (pH 4.5-6) 4.96 9.35 -3.52 1 2 0 37 302.458 2 ↓

Activity (Go SEA)

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