UCSF

ZINC16577833

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 31st, 2008 29 No

Popular Name: N-[[(2R,3S)-3-(4-chlorophenyl)-6,6-dimethyl-2-nitro-2,3,5,7-tetrahydrobenzofuran-4-ylidene]amino]ani N-[[(2R,3S)-3-(4-chlorophenyl)-6…

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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) 7.91 12.36 -8.71 1 6 0 79 411.889 4 ↓
Lo Low (pH 4.5-6) 7.91 12.51 -7.48 1 6 0 79 411.889 4 ↓
Lo Low (pH 4.5-6) 7.91 12.65 -8.34 1 6 0 79 411.889 4 ↓
Lo Low (pH 4.5-6) 7.91 12.86 -9.31 1 6 0 79 411.889 4 ↓

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

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