In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 18 | Yes |
Popular Name: (1-aminocyclopentyl)-[4-[(1R)-1-methylpropyl]piperazin-1-yl]methanone (1-aminocyclopentyl)-[4-[(1R)-1-…
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) | 1.64 | 3.14 | -48.39 | 3 | 4 | 1 | 51 | 254.398 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.64 | 2.94 | -6.07 | 2 | 4 | 0 | 50 | 253.39 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 4.99 | -109.58 | 4 | 4 | 2 | 52 | 255.406 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.