In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 12th, 2010 | 20 | Yes |
Popular Name: (1R)-N-[(4-ethylphenyl)methyl]-N-methyl-1-(5-methyl-2-furyl)ethane-1,2-diamine (1R)-N-[(4-ethylphenyl)methyl]-N…
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) | 2.52 | 8.32 | -117.69 | 4 | 3 | 2 | 45 | 274.408 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.52 | 5.86 | -4.13 | 2 | 3 | 0 | 42 | 272.392 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.52 | 6.72 | -46.48 | 3 | 3 | 1 | 44 | 273.4 | 6 | ↓ |