In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 18 | Yes |
Popular Name: N-[(R)-(1-methylimidazol-2-yl)-(2-thienyl)methyl]pentan-1-amine N-[(R)-(1-methylimidazol-2-yl)-(…
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) | 3.28 | 7.86 | -26.52 | 2 | 3 | 1 | 31 | 264.418 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.28 | 8.42 | -36.38 | 2 | 3 | 1 | 34 | 264.418 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.28 | 7.26 | -7.91 | 1 | 3 | 0 | 30 | 263.41 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.28 | 9.05 | -102.83 | 3 | 3 | 2 | 36 | 265.426 | 7 | ↓ |