UCSF

ZINC58314867

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2011 25 Yes

Popular Name: 1-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-[[(6S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-6-yl]meth 1-(3,5-dimethyl-1-phenyl-pyrazol…

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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) 1.88 8.02 -61.9 3 6 1 64 337.451 5 ↓
Hi High (pH 8-9.5) 1.88 6.83 -12.26 2 6 0 60 336.443 5 ↓
Mid Mid (pH 6-8) 1.88 8.18 -108.08 4 6 2 66 338.459 5 ↓

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

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