UCSF

ZINC60017625

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2011 39 No

Popular Name: 2-[(5S)-2-[(N'Z)-N'-[(E)-1-methyl-3-(2,6,6-trimethylcyclohexen-1-yl)prop-2-enylidene]hydrazino]-4-ox 2-[(5S)-2-[(N'Z)-N'-[(E)-1-methy…

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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) 6.85 12.48 -50.69 1 8 -1 110 541.701 9 ↓
Lo Low (pH 4.5-6) 6.85 12.57 -19.72 2 8 0 108 542.709 9 ↓

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

No pre-computed analogs available. Try a structural similarity search.