In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 16 | Yes |
Popular Name: (1S)-N-[(2-methylthiazol-4-yl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine (1S)-N-[(2-methylthiazol-4-yl)me…
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) | -0.04 | 5.4 | -42.88 | 2 | 5 | 1 | 60 | 238.34 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.04 | 4.24 | -15.03 | 1 | 5 | 0 | 56 | 237.332 | 4 | ↓ |