| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 12th, 2008 | 21 | Yes |
Popular Name: (2R)-2-[[(2S)-2-amino-3-(1H-imidazol-4-yl)propanoyl]amino]-3-(1H-imidazol-4-yl)propanoic (2R)-2-[[(2S)-2-amino-3-(1H-imid…
None
| 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) | -3.88 | 2.71 | -99.78 | 7 | 9 | 1 | 155 | 293.307 | 7 | ↓ |
| Hi High (pH 8-9.5) | -3.88 | 2.46 | -57.71 | 5 | 9 | -1 | 153 | 291.291 | 7 | ↓ |
| Hi High (pH 8-9.5) | -3.88 | 1.99 | -58.1 | 5 | 9 | -1 | 153 | 291.291 | 7 | ↓ |
| Hi High (pH 8-9.5) | -3.88 | 2.47 | -60.74 | 5 | 9 | -1 | 153 | 291.291 | 7 | ↓ |
| Hi High (pH 8-9.5) | -3.88 | 1.9 | -56.04 | 5 | 9 | -1 | 153 | 291.291 | 7 | ↓ |
| Mid Mid (pH 6-8) | -3.88 | 2.64 | -62.47 | 6 | 9 | 0 | 154 | 292.299 | 7 | ↓ |
| Mid Mid (pH 6-8) | -3.88 | 2.23 | -57.95 | 6 | 9 | 0 | 154 | 292.299 | 7 | ↓ |
| Mid Mid (pH 6-8) | -3.88 | 2.21 | -61.17 | 6 | 9 | 0 | 154 | 292.299 | 7 | ↓ |
| Mid Mid (pH 6-8) | -3.88 | 2.72 | -59.84 | 6 | 9 | 0 | 154 | 292.299 | 7 | ↓ |
| Mid Mid (pH 6-8) | -3.88 | 2.79 | -90.48 | 7 | 9 | 1 | 155 | 293.307 | 7 | ↓ |
| Lo Low (pH 4.5-6) | -3.88 | 3.28 | -168.06 | 8 | 9 | 2 | 157 | 294.315 | 7 | ↓ |
| Lo Low (pH 4.5-6) | -3.88 | 3.19 | -170.9 | 8 | 9 | 2 | 157 | 294.315 | 7 | ↓ |
