UCSF

ZINC69701105

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2011 33 No

Popular Name: 4-[(6S)-3-(4-isopropylphenyl)-2-oxo-6,7-dihydro-[1,2,4]triazino[2,3-c]quinazolin-6-yl]benzoic 4-[(6S)-3-(4-isopropylphenyl)-2-…

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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) 5.84 12.68 -59.39 2 7 0 105 438.487 4 ↓
Hi High (pH 8-9.5) 6.30 11.9 -59.45 1 7 -1 108 437.479 4 ↓

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

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