In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2010 | 14 | Yes |
Popular Name: 1-(2-methyl-1H-imidazol-4-yl)-N-(1H-tetrazol-5-ylmethyl)methanamine 1-(2-methyl-1H-imidazol-4-yl)-N-…
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) | -1.37 | 0.32 | -43.43 | 3 | 7 | 0 | 98 | 193.214 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.37 | -1.02 | -43.95 | 2 | 7 | -1 | 93 | 192.206 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.37 | -0.57 | -47.56 | 3 | 7 | 0 | 95 | 193.214 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.37 | 0.79 | -83.76 | 4 | 7 | 1 | 99 | 194.222 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.