In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2011 | 15 | Yes |
Popular Name: N'-cyclopropyl-N'-methyl-N-[(1-methylpyrazol-4-yl)methyl]ethane-1,2-diamine N'-cyclopropyl-N'-methyl-N-[(1-m…
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) | 0.27 | 4.4 | -36.31 | 2 | 4 | 1 | 34 | 209.317 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.27 | 1.94 | -5.91 | 1 | 4 | 0 | 33 | 208.309 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.27 | 5.75 | -114.75 | 3 | 4 | 2 | 39 | 210.325 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.27 | 3.31 | -43.44 | 2 | 4 | 1 | 38 | 209.317 | 6 | ↓ |