UCSF

ZINC69842983

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 30th, 2011 28 No

Popular Name: (3Z)-6-chloro-3-[(4-hydroxy-3-methoxy-5-nitro-phenyl)methylene]-1,2-dihydropyrrolo[2,1-b]quinazolin- (3Z)-6-chloro-3-[(4-hydroxy-3-me…

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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) 3.46 9.42 -21.86 1 8 0 110 399.79 3 ↓
Mid Mid (pH 6-8) 3.46 10.49 -61.81 0 8 -1 113 398.782 3 ↓

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

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