In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 21 | Yes |
Popular Name: 2-[cyclopentyl-[(3S)-3-(ethylamino)-3-phenyl-propyl]amino]ethanol 2-[cyclopentyl-[(3S)-3-(ethylami…
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) | 2.22 | 7.06 | -35.16 | 3 | 3 | 1 | 37 | 291.459 | 9 | ↓ |
Lo Low (pH 4.5-6) | 2.22 | 8.03 | -112.14 | 4 | 3 | 2 | 41 | 292.467 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.