| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 27 | Yes |
Popular Name: [(2S)-3-[ethyl-[(oxoBLAHyl)methyl]amino]-2-hydroxy-propyl] [(2S)-3-[ethyl-[(oxoBLAHyl)methy…
| 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) | 2.03 | 8.31 | -56.44 | 3 | 7 | 1 | 97 | 394.517 | 10 | ↓ |
| Hi High (pH 8-9.5) | 2.49 | 5.49 | -51.21 | 2 | 7 | 0 | 100 | 393.509 | 10 | ↓ |
| Hi High (pH 8-9.5) | 2.03 | 6.03 | -16.56 | 2 | 7 | 0 | 96 | 393.509 | 10 | ↓ |
