UCSF

ZINC20358810

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2008 31 No

Popular Name: (5S)-5-(4-allyloxyphenyl)-1-(3-dimethylaminopropyl)-3-hydroxy-4-(pyridine-4-carbonyl)-5H-pyrrol-2-on (5S)-5-(4-allyloxyphenyl)-1-(3-d…

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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) 2.09 9.78 -74.88 1 7 0 87 421.497 10 ↓
Lo Low (pH 4.5-6) 2.09 8.95 -54.17 2 7 1 84 422.505 10 ↓

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