In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 19 | Yes |
Popular Name: (5-amino-2-methyl-3-pyridyl)-(4-cyclopropylpiperazin-1-yl)methanone (5-amino-2-methyl-3-pyridyl)-(4-…
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) | -0.06 | 4.34 | -43.23 | 3 | 5 | 1 | 64 | 261.349 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.06 | 2.15 | -8.83 | 2 | 5 | 0 | 62 | 260.341 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.06 | 4.74 | -85.99 | 4 | 5 | 2 | 65 | 262.357 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.