In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 19 | Yes |
Popular Name: N-[(1S)-1-ethyl-2-methyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propyl]cyclopropanamine N-[(1S)-1-ethyl-2-methyl-1-(4,5,…
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) | 4.02 | 8.56 | -28.97 | 2 | 2 | 1 | 29 | 279.473 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.02 | 8.01 | -3.29 | 1 | 2 | 0 | 25 | 278.465 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.02 | 9.06 | -85.51 | 3 | 2 | 2 | 31 | 280.481 | 5 | ↓ |