In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 27 | Yes |
Popular Name: (2R)-2-amino-1-(3-benzhydryl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)propan-1-one (2R)-2-amino-1-(3-benzhydryl-1,4…
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) | 2.26 | 7.8 | -50.45 | 4 | 5 | 1 | 77 | 361.469 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.26 | 7.47 | -12.16 | 3 | 5 | 0 | 75 | 360.461 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.