In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 19 | Yes |
Popular Name: (4S)-1-methyl-N-[(1S)-1-(3-pyridyl)ethyl]-4,5,6,7-tetrahydroindazol-4-amine (4S)-1-methyl-N-[(1S)-1-(3-pyrid…
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) | 0.70 | 6.25 | -43.08 | 2 | 4 | 1 | 47 | 257.361 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.70 | 5.33 | -8.34 | 1 | 4 | 0 | 43 | 256.353 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.70 | 6.41 | -103 | 3 | 4 | 2 | 49 | 258.369 | 3 | ↓ |