In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2011 | 15 | Yes |
Popular Name: 5-[(cyclopropylmethylamino)methyl]-N,N,1-trimethyl-imidazol-2-amine 5-[(cyclopropylmethylamino)methy…
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) | 1.08 | 8.13 | -96.34 | 3 | 4 | 2 | 39 | 210.325 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.08 | 6.76 | -24.72 | 2 | 4 | 1 | 34 | 209.317 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.08 | 6.3 | -6.76 | 1 | 4 | 0 | 33 | 208.309 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.08 | 7.67 | -44.22 | 2 | 4 | 1 | 38 | 209.317 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.