UCSF

ZINC67975079

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2011 26 Yes

Popular Name: (2S,4R)-4-[4-[[[(1R)-1,2-dimethylpropyl]carbamoylamino]methyl]triazol-1-yl]-N-isopropyl-pyrrolidine- (2S,4R)-4-[4-[[[(1R)-1,2-dimethy…

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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) 0.42 1.81 -61.44 5 9 1 118 366.49 7 ↓
Hi High (pH 8-9.5) 0.42 0.53 -17.89 4 9 0 113 365.482 7 ↓

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

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