UCSF

ZINC38592570

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 27 No

Popular Name: 3-[(E)-(2-hydroxy-3-methoxy-phenyl)methyleneamino]-8-methyl-pyrimido[5,4-b]indole-2,4-dione 3-[(E)-(2-hydroxy-3-methoxy-phen…

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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) 2.39 3.62 -21.4 1 8 0 107 362.345 3 ↓
Hi High (pH 8-9.5) 2.39 4.54 -70.84 0 8 -1 110 361.337 3 ↓

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

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