In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2009 | 21 | Yes |
Popular Name: 2-[4-[2-[[(1R)-1-acetyl-2-methyl-propyl]amino]-2-oxo-ethyl]piperazin-1-yl]acetic 2-[4-[2-[[(1R)-1-acetyl-2-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) | -1.17 | 4.74 | -34.13 | 2 | 7 | 0 | 94 | 299.371 | 7 | ↓ |
Mid Mid (pH 6-8) | -1.17 | 4.71 | -57.57 | 2 | 7 | 0 | 94 | 299.371 | 7 | ↓ |
Mid Mid (pH 6-8) | -1.17 | 2.08 | -51.66 | 1 | 7 | -1 | 93 | 298.363 | 7 | ↓ |