UCSF

ZINC63952559

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 8th, 2011 21 Yes

Popular Name: 3-[2-(5-chloro-2H-indol-3-yl)ethylamino]-6-methyl-4H-1,2,4-triazin-5-one 3-[2-(5-chloro-2H-indol-3-yl)eth…

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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) 2.01 4.95 -47.06 3 6 1 85 304.761 4 ↓
Mid Mid (pH 6-8) 2.47 3.57 -57.74 2 6 0 88 303.753 4 ↓

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

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