UCSF

ZINC13671587

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 23rd, 2008 26 Yes

Popular Name: (1R,4S,5S,6S)-4-[[(2S)-2-aminopropanoyl]amino]-4-[[(1S)-1-carboxy-3-methyl-butyl]carbamoyl]bicyclo[3 (1R,4S,5S,6S)-4-[[(2S)-2-aminopr…

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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) -1.80 5.2 -113.23 5 9 -1 166 368.41 8 ↓
Hi High (pH 8-9.5) -1.80 4.87 -110.88 4 9 -2 164 367.402 8 ↓

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Rings

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

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