| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 19th, 2011 | 23 | Yes |
Popular Name: 1-cyano-N-[(1S)-1-[3-(methanesulfonamido)phenyl]ethyl]cyclopentanecarboxamide 1-cyano-N-[(1S)-1-[3-(methanesul…
| 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) | 2.18 | 3.88 | -42.53 | 1 | 6 | -1 | 101 | 334.421 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.44 | 5.99 | -12.58 | 1 | 4 | 0 | 47 | 279.702 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.18 | 3.85 | -14.28 | 2 | 6 | 0 | 99 | 335.429 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
