In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2009 | 11 | Yes |
Popular Name: (1S,2S)-N1-(4-methylthiazol-2-yl)cyclopropane-1,2-diamine (1S,2S)-N1-(4-methylthiazol-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) | 0.58 | 1.19 | -48.77 | 4 | 3 | 1 | 53 | 170.261 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.58 | 0.87 | -4.95 | 3 | 3 | 0 | 51 | 169.253 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.58 | 1.64 | -91.52 | 5 | 3 | 2 | 54 | 171.269 | 2 | ↓ |