In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 18 | Yes |
Popular Name: N',N'-dimethyl-N-[(R)-(1-methylimidazol-2-yl)-(2-thienyl)methyl]ethane-1,2-diamine N',N'-dimethyl-N-[(R)-(1-methyli…
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) | 1.37 | 6.79 | -83.96 | 3 | 4 | 2 | 36 | 266.414 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.37 | 3.81 | -7.43 | 1 | 4 | 0 | 33 | 264.398 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.37 | 6.28 | -38.84 | 2 | 4 | 1 | 34 | 265.406 | 6 | ↓ |