UCSF

ZINC35498832

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2009 33 Yes

Popular Name: [(2R)-3-[[1-[(2-fluorophenyl)methyl]pyrrol-2-yl]methyl-(2-morpholinoethyl)amino]-2-hydroxy-propyl] [(2R)-3-[[1-[(2-fluorophenyl)met…

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Download: MOL2 SDF SMILES Flexibase

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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) 2.90 9.84 -53.26 2 7 1 68 462.586 14 ↓
Hi High (pH 8-9.5) 2.90 7.47 -11.04 1 7 0 67 461.578 14 ↓
Lo Low (pH 4.5-6) 2.90 9.74 -47.12 2 7 1 68 462.586 14 ↓

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