In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2010 | 19 | Yes |
Popular Name: N-[[1-(cyclopentylmethyl)-3,5-dimethyl-pyrazol-4-yl]methyl]-2-methyl-propan-2-amine N-[[1-(cyclopentylmethyl)-3,5-di…
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) | 3.29 | 8.14 | -37.16 | 2 | 3 | 1 | 34 | 264.437 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.29 | 6.94 | -4.9 | 1 | 3 | 0 | 30 | 263.429 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.