In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 17 | Yes |
Popular Name: 4-chloro-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]benzene-1,2-diamine 4-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) | 2.68 | 5.93 | -38.87 | 4 | 3 | 1 | 42 | 254.785 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.68 | 3.57 | -4.71 | 3 | 3 | 0 | 41 | 253.777 | 4 | ↓ |