UCSF

ZINC36107532

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 28 No

Popular Name: 3-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]-N-[(4-hydroxy-3-methoxy-5-nitro-phenyl)methyleneamino]pro 3-[(3,5-dioxo-2H-1,2,4-triazin-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) -0.43 -0.95 -27.69 5 14 0 207 393.316 8 ↓
Hi High (pH 8-9.5) 0.03 -1.55 -104.03 3 14 -2 213 391.3 8 ↓
Mid Mid (pH 6-8) 0.03 -2.62 -60.04 4 14 -1 210 392.308 8 ↓

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

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