UCSF

ZINC69691365

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2011 14 Yes

Popular Name: 3-[(1S)-1,2-dimethylpropyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine 3-[(1S)-1,2-dimethylpropyl]-5,6,…

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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) 0.72 4.87 -55.43 2 4 1 47 195.29 2 ↓
Mid Mid (pH 6-8) 0.72 3.5 -10.18 1 4 0 43 194.282 2 ↓

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

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