UCSF

ZINC08836900

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 29th, 2007 36 No

Popular Name: 4-[hydroxy-(4-methoxy-2-methyl-phenyl)-methylene]-1-(3-morpholinopropyl)-5-(3-nitrophenyl)-pyrrolidi 4-[hydroxy-(4-methoxy-2-methyl-p…

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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) 2.89 8.71 -52.59 0 10 -1 128 494.524 9 ↓
Mid Mid (pH 6-8) 2.31 0.11 -58.06 1 10 1 123 496.54 9 ↓
Mid Mid (pH 6-8) 2.89 11.03 -72.95 1 10 0 129 495.532 9 ↓

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