UCSF

ZINC09233615

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 15th, 2007 32 No

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

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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) 3.78 10.46 -60.02 0 6 -1 83 492.349 6 ↓
Mid Mid (pH 6-8) 4.23 10 -13.42 1 6 0 80 493.357 5 ↓
Lo Low (pH 4.5-6) 4.23 10.29 -41.13 2 6 1 81 494.365 5 ↓

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