UCSF

ZINC62977211

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 21st, 2011 37 No

Popular Name: (2Z)-2-[[4-(diethylamino)phenyl]methylene]-6-hydroxy-4-methyl-7-[[(2S)-2-(3-pyridyl)-1-piperidyl]met (2Z)-2-[[4-(diethylamino)phenyl]…

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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) 5.41 14.23 -98.24 3 6 0 72 499.655 7 ↓
Hi High (pH 8-9.5) 5.41 14.83 -34.85 1 6 0 74 497.639 7 ↓
Hi High (pH 8-9.5) 5.41 12.01 -9.67 1 6 0 70 497.639 7 ↓
Mid Mid (pH 6-8) 5.41 14.99 -80.97 2 6 0 75 498.647 7 ↓
Mid Mid (pH 6-8) 5.41 14.06 -39.75 2 6 1 71 498.647 7 ↓

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

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