UCSF

ZINC33698342

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 16th, 2009 29 No

Popular Name: (4E,5S)-4-[(2,5-dimethylphenyl)-hydroxy-methylene]-5-(2-furyl)-1-(4-pyridylmethyl)pyrrolidine-2,3-di (4E,5S)-4-[(2,5-dimethylphenyl)-…

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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) 2.57 9.19 -43 0 6 -1 86 387.415 5 ↓
Lo Low (pH 4.5-6) 2.57 8.06 -18.34 1 6 0 84 388.423 5 ↓
Lo Low (pH 4.5-6) 2.57 8.5 -49.33 2 6 1 85 389.431 5 ↓

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