In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2009 | 22 | Yes |
Popular Name: 4-[[(2S)-2-(azepan-1-yl)propanoyl]amino]-N-methyl-benzamide 4-[[(2S)-2-(azepan-1-yl)propanoy…
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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) | 2.08 | 5.91 | -46.9 | 3 | 5 | 1 | 63 | 304.414 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.27 | 4.3 | -33.29 | 2 | 5 | 0 | 69 | 303.406 | 4 | ↓ |