In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 19 | Yes |
Popular Name: (2S)-N2-[(3-methoxyphenyl)methyl]-N1,N1,4-trimethyl-pentane-1,2-diamine (2S)-N2-[(3-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) | 3.20 | 7.22 | -34.37 | 2 | 3 | 1 | 26 | 265.421 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.20 | 8.21 | -114.32 | 3 | 3 | 2 | 30 | 266.429 | 8 | ↓ |