UCSF

ZINC65526006

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 21 No

Popular Name: 5-[[(3R,5S)-2-(4-chlorophenyl)-5-cyclopropyl-1,2,4-triazolidin-3-yl]methyl]-1H-tetrazole 5-[[(3R,5S)-2-(4-chlorophenyl)-5…

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Vendors

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) 2.17 2.81 -35.45 2 7 -1 80 304.765 4 ↓
Mid Mid (pH 6-8) 2.17 4.16 -33.13 3 7 0 85 305.773 4 ↓
Mid Mid (pH 6-8) 2.17 2.81 -5.24 3 7 0 82 305.773 4 ↓
Lo Low (pH 4.5-6) 2.17 4.3 -48.91 4 7 1 86 306.781 4 ↓

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

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