UCSF

ZINC69567517

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2011 24 Yes

Popular Name: (2S)-N-allyl-2-[[(6S)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]-N-(2-thienylmethy (2S)-N-allyl-2-[[(6S)-5,6,7,8-te…

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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) 1.27 8.84 -52.56 2 6 1 68 346.48 7 ↓
Mid Mid (pH 6-8) 1.27 7.7 -11.63 1 6 0 63 345.472 7 ↓

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

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