UCSF

ZINC09007959

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 4th, 2007 30 No

Popular Name: 5-(3-bromophenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(4-methoxy-3-methyl-phenyl)-methylene]-pyrroli 5-(3-bromophenyl)-1-(2-dimethyla…

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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) 3.63 10.09 -73.38 1 6 0 74 473.367 7 ↓
Hi High (pH 8-9.5) 3.63 7.56 -60.23 0 6 -1 73 472.359 7 ↓
Mid Mid (pH 6-8) 3.04 0.49 -49.07 1 6 1 68 474.375 7 ↓

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