In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 15 | Yes |
Popular Name: (1R)-N-cyclopropyl-N-ethyl-1-(2-pyridyl)ethane-1,2-diamine (1R)-N-cyclopropyl-N-ethyl-1-(2-…
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) | 0.30 | 5.09 | -24.87 | 3 | 3 | 1 | 43 | 206.313 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.30 | 2.9 | -4.35 | 2 | 3 | 0 | 42 | 205.305 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.30 | 5.47 | -115.81 | 4 | 3 | 2 | 45 | 207.321 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.30 | 3.07 | -44.67 | 3 | 3 | 1 | 44 | 206.313 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.30 | 2.9 | -99.73 | 4 | 3 | 2 | 45 | 207.321 | 5 | ↓ |