In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 19 | Yes |
Popular Name: (2R)-N-[(4-methoxyphenyl)methyl]-N',N',4-trimethyl-pentane-1,2-diamine (2R)-N-[(4-methoxyphenyl)methyl]…
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) | 3.22 | 6.46 | -42.15 | 2 | 3 | 1 | 29 | 265.421 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.22 | 7.33 | -34.13 | 2 | 3 | 1 | 26 | 265.421 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.22 | 8.58 | -127.29 | 3 | 3 | 2 | 30 | 266.429 | 8 | ↓ |