UCSF

ZINC58327836

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2011 22 Yes

Popular Name: (1S)-1-(4-methoxyphenyl)-2-[[(6S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-6-yl]methylamino]ethano (1S)-1-(4-methoxyphenyl)-2-[[(6S…

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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) 0.90 2.9 -59.58 4 6 1 76 303.386 6 ↓
Hi High (pH 8-9.5) 0.90 1.71 -9.64 3 6 0 71 302.378 6 ↓
Mid Mid (pH 6-8) 0.90 3.06 -104.01 5 6 2 77 304.394 6 ↓

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

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