UCSF

ZINC36157017

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 27 Yes

Popular Name: 2-[[cyclopropyl-[(2R)-2-hydroxy-3-prop-2-ynoxy-propyl]amino]methyl]-5,6,7,8-tetrahydro-3H-benzothiop 2-[[cyclopropyl-[(2R)-2-hydroxy-…

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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) 1.69 7.59 -53.85 3 6 1 80 388.513 8 ↓
Hi High (pH 8-9.5) 2.15 4.89 -51.18 2 6 0 83 387.505 8 ↓
Hi High (pH 8-9.5) 1.69 5.45 -15.34 2 6 0 78 387.505 8 ↓

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