UCSF

ZINC36160938

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 23 Yes

Popular Name: 2-[[[(2S)-2-hydroxy-3-methyl-butyl]-methyl-amino]methyl]-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d] 2-[[[(2S)-2-hydroxy-3-methyl-but…

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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) 2.31 6.91 -52.54 3 5 1 70 336.481 5 ↓
Hi High (pH 8-9.5) 2.31 4.5 -12.32 2 5 0 69 335.473 5 ↓
Hi High (pH 8-9.5) 2.76 4.21 -47.32 2 5 0 74 335.473 5 ↓

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