In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 13th, 2010 | 28 | Yes |
Popular Name: (2S)-2-[[(2S,3R)-3-amino-2-hydroxy-4-(4-phenylphenyl)butanoyl]amino]-4-methyl-pentanoic (2S)-2-[[(2S,3R)-3-amino-2-hydro…
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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) | 0.67 | 8.02 | -54.21 | 5 | 6 | 0 | 117 | 384.476 | 9 | ↓ |
Hi High (pH 8-9.5) | 0.67 | 8.44 | -67.54 | 4 | 6 | -1 | 120 | 383.468 | 9 | ↓ |
Mid Mid (pH 6-8) | 0.67 | 7.7 | -51.7 | 4 | 6 | -1 | 115 | 383.468 | 9 | ↓ |