In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 29 | Yes |
Popular Name: (2S)-N-[(2-methoxyphenyl)methyl]-2-[4-(2-morpholino-2-oxo-ethyl)piperazin-1-yl]propanamide (2S)-N-[(2-methoxyphenyl)methyl]…
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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) | 0.28 | 4.27 | -41.45 | 2 | 8 | 1 | 76 | 405.519 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.28 | 2.12 | -17.11 | 1 | 8 | 0 | 74 | 404.511 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.28 | 4.35 | -47.25 | 2 | 8 | 1 | 76 | 405.519 | 7 | ↓ |