| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 37 | Yes |
Popular Name: (2S)-2-[(hydroxy-methoxy-methyl-BLAHyl)amino]-3-(1H-indol-3-yl)propanoic (2S)-2-[(hydroxy-methoxy-methyl-…
| 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) | 1.43 | 8.42 | -70.28 | 5 | 8 | 1 | 116 | 504.607 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.43 | 5.84 | -69.65 | 3 | 8 | -1 | 110 | 502.591 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.43 | 7.58 | -95.67 | 4 | 8 | 0 | 111 | 503.599 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.43 | 6.78 | -29.65 | 4 | 8 | 0 | 114 | 503.599 | 6 | ↓ |
