UCSF

ZINC62780121

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 12th, 2011 20 Yes

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

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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) 1.14 4.53 -11.63 2 6 0 71 266.308 2 ↓
Mid Mid (pH 6-8) 1.14 5.96 -53.05 3 6 1 76 267.316 2 ↓

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

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