UCSF

ZINC43212299

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2010 31 No

Popular Name: (1R,3R,3aS,6aS)-3-butyl-5-tert-butyl-1-(4-methoxycarbonylphenyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrro (1R,3R,3aS,6aS)-3-butyl-5-tert-b…

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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) 1.44 11.12 -42.03 2 8 0 120 430.501 8 ↓
Mid Mid (pH 6-8) 1.44 10.16 -47.82 1 8 -1 116 429.493 8 ↓

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