In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 27 | Yes |
Popular Name: 1-[(5S)-2-chloro-5H-purin-6-yl]-N-[3-(diethylamino)propyl]piperidine-4-carboxamide 1-[(5S)-2-chloro-5H-purin-6-yl]-…
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) | 1.20 | 8.13 | -50.01 | 2 | 8 | 1 | 86 | 394.931 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.