UCSF

ZINC60219598

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 17th, 2011 41 No

Popular Name: (8S,10R,13R,14R,16S,17S)-17-acetyl-2-[(2S)-2-[3-(diethylamino)-2-pyridyl]piperazin-1-yl]-10,13,16-tr (8S,10R,13R,14R,16S,17S)-17-acet…

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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) 5.11 15.91 -42.37 2 6 1 70 557.803 6 ↓
Hi High (pH 8-9.5) 5.11 14.57 -12.81 1 6 0 66 556.795 6 ↓
Lo Low (pH 4.5-6) 0.69 15.97 -108.79 2 6 2 70 558.811 5 ↓

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