UCSF

ZINC20280632

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 34 No

Popular Name: (5R)-1-(2-dimethylaminoethyl)-3-hydroxy-4-(4-methoxybenzoyl)-5-(3-methoxy-4-propoxy-phenyl)-5H-pyrro (5R)-1-(2-dimethylaminoethyl)-3-…

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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) 2.99 10.26 -75.12 1 8 0 93 468.55 11 ↓
Hi High (pH 8-9.5) 2.99 7.72 -58.27 0 8 -1 91 467.542 11 ↓
Lo Low (pH 4.5-6) 2.99 9.44 -57.72 2 8 1 90 469.558 11 ↓

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