In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 18 | Yes |
Popular Name: (1S)-N-cyclopentyl-1-(4-methoxyphenyl)-N-methyl-ethane-1,2-diamine (1S)-N-cyclopentyl-1-(4-methoxyp…
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) | 2.19 | 5.85 | -129.08 | 4 | 3 | 2 | 41 | 250.386 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.19 | 6.48 | -31.76 | 3 | 3 | 1 | 40 | 249.378 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.19 | 4.07 | -45.94 | 3 | 3 | 1 | 40 | 249.378 | 5 | ↓ |