In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 15 | Yes |
Popular Name: (1S,2S)-N-(1,3-benzothiazol-2-ylmethyl)-2-methyl-cyclopropanamine (1S,2S)-N-(1,3-benzothiazol-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) | 2.64 | 6.18 | -37.71 | 2 | 2 | 1 | 29 | 219.333 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.64 | 4.88 | -6.93 | 1 | 2 | 0 | 25 | 218.325 | 3 | ↓ |