In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 21 | No |
Popular Name: 2-chloro-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-5-nitro-benzamide 2-chloro-N-[[(2S)-1-ethylpyrroli…
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) | 2.49 | 7.94 | -42.31 | 2 | 6 | 1 | 79 | 312.777 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.49 | 5.63 | -9.41 | 1 | 6 | 0 | 78 | 311.769 | 5 | ↓ |