In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 24 | Yes |
Popular Name: 1-(4,5-dimethyl-1,2,4-triazol-3-yl)-N-[(3-isopentyloxy-4-methoxy-phenyl)methyl]methanamine 1-(4,5-dimethyl-1,2,4-triazol-3-…
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) | 1.91 | 9.38 | -59.59 | 2 | 6 | 1 | 66 | 333.456 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.91 | 8.03 | -14.86 | 1 | 6 | 0 | 61 | 332.448 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.