In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 17 | Yes |
Popular Name: (3R)-N3-[(3-methoxyphenyl)methyl]-N1,N1-dimethyl-butane-1,3-diamine (3R)-N3-[(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) | 2.16 | 7.19 | -104.7 | 3 | 3 | 2 | 30 | 238.375 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.16 | 4.72 | -38.47 | 2 | 3 | 1 | 29 | 237.367 | 7 | ↓ |