UCSF

ZINC20064641

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2008 39 No

Popular Name: (5R)-4-(4-benzyloxy-2-methyl-benzoyl)-1-(2-diethylaminoethyl)-5-(4-ethylphenyl)-3-hydroxy-5H-pyrrol- (5R)-4-(4-benzyloxy-2-methyl-ben…

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Download: MOL2 SDF SMILES Flexibase

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) 6.10 16.69 -68.4 1 6 0 74 526.677 12 ↓
Hi High (pH 8-9.5) 6.10 14.33 -59.92 0 6 -1 73 525.669 12 ↓
Lo Low (pH 4.5-6) 6.10 15.73 -46.34 2 6 1 71 527.685 12 ↓

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