UCSF

ZINC35544577

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2009 33 No

Popular Name: [(4aR,5S)-3-methyl-8-nitro-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinolin-5-yl]-(4-benzyl-1-piperidyl [(4aR,5S)-3-methyl-8-nitro-1,2,4…

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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) 4.14 14.8 -56.81 1 7 1 74 449.575 4 ↓
Mid Mid (pH 6-8) 4.14 12.37 -14.62 0 7 0 73 448.567 4 ↓

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