In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2010 | 16 | Yes |
Popular Name: 2-[[(1R)-2-amino-1-(3-methyl-2-thienyl)ethyl]-cyclopropyl-amino]ethanol 2-[[(1R)-2-amino-1-(3-methyl-2-t…
None
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) | 0.74 | 2.6 | -110.98 | 5 | 3 | 2 | 52 | 242.388 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.74 | 0.76 | -4.04 | 3 | 3 | 0 | 49 | 240.372 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.74 | 2.21 | -25.11 | 4 | 3 | 1 | 51 | 241.38 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.74 | 0.95 | -41.94 | 4 | 3 | 1 | 51 | 241.38 | 6 | ↓ |