| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2010 | 28 | Yes |
Popular Name: 2-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]acetamide 2-[[(1S)-1-(3-fluorophenyl)ethyl…
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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) | 2.77 | 4.86 | -14.26 | 3 | 6 | 0 | 73 | 384.455 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.77 | 5.95 | -53.09 | 4 | 6 | 1 | 78 | 385.463 | 7 | ↓ |
