In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 22nd, 2009 | 30 | No |
Popular Name: 2-[methyl-[(1R)-1-(3-nitrophenyl)ethyl]amino]-N-[5-methyl-2-(o-tolyl)pyrazol-3-yl]acetamide 2-[methyl-[(1R)-1-(3-nitrophenyl…
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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) | 4.09 | 13.47 | -60.85 | 2 | 8 | 1 | 97 | 408.482 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.09 | 11.51 | -16.02 | 1 | 8 | 0 | 96 | 407.474 | 7 | ↓ |