In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 29 | Yes |
Popular Name: (3S)-N-[2-(1H-indol-3-yl)ethyl]-3,5,5-trimethyl-N-(4-pyridylmethyl)hexanamide (3S)-N-[2-(1H-indol-3-yl)ethyl]-…
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) | 4.72 | 12.73 | -15.35 | 1 | 4 | 0 | 49 | 391.559 | 9 | ↓ |
Lo Low (pH 4.5-6) | 4.72 | 13.19 | -49.68 | 2 | 4 | 1 | 50 | 392.567 | 9 | ↓ |