UCSF

ZINC39758032

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2010 33 No

Popular Name: (2R)-2-[[4-allyl-5-[(1S)-1-[[2-(4-methoxyphenyl)acetyl]amino]ethyl]-1,2,4-triazol-3-yl]sulfanyl]-N-( (2R)-2-[[4-allyl-5-[(1S)-1-[[2-(…

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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) 2.19 7.69 -19.11 2 9 0 111 488.639 10 ↓
Lo Low (pH 4.5-6) 2.19 8.83 -42.13 3 9 1 112 489.647 10 ↓

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